data_4635 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 4635 _Entry.Title ; Solution structure of the interacting domains of the Mad-Sin3 complex: implications for recruitment of a chromatin-modifying complex ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2000-10-11 _Entry.Accession_date 2001-03-10 _Entry.Last_release_date 2001-05-07 _Entry.Original_release_date 2001-05-07 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 2.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 K. Brubaker . . . 4635 2 S. Cowley . M. . 4635 3 K. Huang . . . 4635 4 R. Eisenman . N. . 4635 5 I. Radhakrishnan . . . 4635 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID coupling_constants 1 4635 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID 'coupling constants' 72 4635 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2001-05-07 2000-10-11 original author . 4635 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 4635 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 11106735 _Citation.Full_citation . _Citation.Title ; Solution structure of the interacting domains of the Mad-Sin3 complex: implications for recruitment of a chromatin-modifying complex ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Cell _Citation.Journal_name_full . _Citation.Journal_volume 103 _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 655 _Citation.Page_last 665 _Citation.Year 2000 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 K. Brubaker . . . 4635 1 2 S. Cowley . M. . 4635 1 3 K. Huang . . . 4635 1 4 L. Loo . . . 4635 1 5 G. Yochum . S. . 4635 1 6 D. Ayer . E. . 4635 1 7 R. Eisenman . N. . 4635 1 8 I. Radhakrishnan . . . 4635 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'Four-helix bundle' 4635 1 'Protein-peptide Complex' 4635 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_MAD1_SIN3A _Assembly.Sf_category assembly _Assembly.Sf_framecode system_MAD1_SIN3A _Assembly.Entry_ID 4635 _Assembly.ID 1 _Assembly.Name 'MAD1 PROTEIN/SIN3A' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state 'not present' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID complex 4635 1 stop_ loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'MAD1 SID domain' 1 $MAD1 . . . native . . . . . 4635 1 2 'mSin3A PAH2 Domain' 2 $SIN3A . . . native . . . . . 4635 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID . PDB 1G1E . . . . . . 4635 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID 'MAD1 PROTEIN/SIN3A' system 4635 1 'MAD1 PROTEIN/SIN3A' abbreviation 4635 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_MAD1 _Entity.Sf_category entity _Entity.Sf_framecode MAD1 _Entity.Entry_ID 4635 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'MAD1 SID domain' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code RMNIQMLLEAADYLER _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 16 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-24 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 1G1E . "Nmr Structure Of The Human Mad1 Transrepression Domain Sid In Complex With Mammalian Sin3a Pah2 Domain" . . . . . 100.00 16 100.00 100.00 8.28e-01 . . . . 4635 1 2 no PDB 1PD7 . "Extended Sid Of Mad1 Bound To The Pah2 Domain Of Msin3b" . . . . . 100.00 24 100.00 100.00 7.00e-01 . . . . 4635 1 3 no PDB 1S5Q . "Solution Structure Of Mad1 Sid-Msin3a Pah2 Complex" . . . . . 100.00 16 100.00 100.00 8.28e-01 . . . . 4635 1 4 no DBJ BAG35605 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 221 100.00 100.00 1.03e+00 . . . . 4635 1 5 no DBJ BAG73371 . "MAX dimerization protein 1 [synthetic construct]" . . . . . 100.00 221 100.00 100.00 1.03e+00 . . . . 4635 1 6 no DBJ BAH13406 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 105 100.00 100.00 4.19e-01 . . . . 4635 1 7 no EMBL CAG38734 . "MAD [Homo sapiens]" . . . . . 100.00 221 100.00 100.00 1.03e+00 . . . . 4635 1 8 no EMBL CAG46493 . "MAD [Homo sapiens]" . . . . . 100.00 221 100.00 100.00 1.03e+00 . . . . 4635 1 9 no GB AAA36194 . "antagonizer of myc transcriptional activity [Homo sapiens]" . . . . . 100.00 221 100.00 100.00 1.03e+00 . . . . 4635 1 10 no GB AAH69377 . "MAX dimerization protein 1 [Homo sapiens]" . . . . . 100.00 221 100.00 100.00 1.03e+00 . . . . 4635 1 11 no GB AAH69433 . "MAX dimerization protein 1 [Homo sapiens]" . . . . . 100.00 221 100.00 100.00 1.03e+00 . . . . 4635 1 12 no GB AAH98396 . "MAX dimerization protein 1 [Homo sapiens]" . . . . . 100.00 221 100.00 100.00 1.03e+00 . . . . 4635 1 13 no GB AAI13532 . "MAX dimerization protein 1 [Homo sapiens]" . . . . . 100.00 221 100.00 100.00 1.03e+00 . . . . 4635 1 14 no REF NP_001179309 . "max dimerization protein 1 [Bos taurus]" . . . . . 100.00 222 100.00 100.00 1.01e+00 . . . . 4635 1 15 no REF NP_001189442 . "max dimerization protein 1 isoform 2 [Homo sapiens]" . . . . . 100.00 220 100.00 100.00 1.01e+00 . . . . 4635 1 16 no REF NP_001189443 . "max dimerization protein 1 isoform 3 [Homo sapiens]" . . . . . 100.00 211 100.00 100.00 9.94e-01 . . . . 4635 1 17 no REF NP_001247787 . "max dimerization protein 1 [Macaca mulatta]" . . . . . 100.00 221 100.00 100.00 1.05e+00 . . . . 4635 1 18 no REF NP_002348 . "max dimerization protein 1 isoform 1 [Homo sapiens]" . . . . . 100.00 221 100.00 100.00 1.03e+00 . . . . 4635 1 19 no SP Q05195 . "RecName: Full=Max dimerization protein 1; Short=Max dimerizer 1; AltName: Full=Protein MAD" . . . . . 100.00 221 100.00 100.00 1.03e+00 . . . . 4635 1 20 no TPG DAA24557 . "TPA: MAX dimerization protein 1-like [Bos taurus]" . . . . . 100.00 222 100.00 100.00 1.01e+00 . . . . 4635 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'MAD1 SID domain' common 4635 1 'MAD1 SID domain' abbreviation 4635 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 6 ARG . 4635 1 2 7 MET . 4635 1 3 8 ASN . 4635 1 4 9 ILE . 4635 1 5 10 GLN . 4635 1 6 11 MET . 4635 1 7 12 LEU . 4635 1 8 13 LEU . 4635 1 9 14 GLU . 4635 1 10 15 ALA . 4635 1 11 16 ALA . 4635 1 12 17 ASP . 4635 1 13 18 TYR . 4635 1 14 19 LEU . 4635 1 15 20 GLU . 4635 1 16 21 ARG . 4635 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . ARG 1 1 4635 1 . MET 2 2 4635 1 . ASN 3 3 4635 1 . ILE 4 4 4635 1 . GLN 5 5 4635 1 . MET 6 6 4635 1 . LEU 7 7 4635 1 . LEU 8 8 4635 1 . GLU 9 9 4635 1 . ALA 10 10 4635 1 . ALA 11 11 4635 1 . ASP 12 12 4635 1 . TYR 13 13 4635 1 . LEU 14 14 4635 1 . GLU 15 15 4635 1 . ARG 16 16 4635 1 stop_ save_ save_SIN3A _Entity.Sf_category entity _Entity.Sf_framecode SIN3A _Entity.Entry_ID 4635 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name 'mSin3A PAH2 Domain' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; SLQNNQPVEFNHAINYVNKI KNRFQGQPDIYKAFLEILHT YQKEQRNAKEAGGNYTPALT EQEVYAQVARLFKNQEDLLS EFGQFLPDA ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 89 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date 2008-08-19 _Entity.DB_query_revised_last_date 2008-08-19 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID . . PDB 1S5R . 'Solution Structure Of Hbp1 Sid-Msin3a Pah2 Complex' . . . . . 100.00 89 100.00 100.00 1.21e-44 . . . . 4635 2 . . GenBank AAK95854 . 'transcriptional co-repressor Sin3A [Homo sapiens]' . . . . . 100.00 621 100.00 100.00 3.89e-46 . . . . 4635 2 . . PDB 1G1E . 'Nmr Structure Of The Human Mad1 Transrepression Domain Sid In Complex With Mammalian Sin3a Pah2 Domain' . . . . . 100.00 89 100.00 100.00 1.21e-44 . . . . 4635 2 . . PDB 1S5Q . 'Solution Structure Of Mad1 Sid-Msin3a Pah2 Complex' . . . . . 100.00 89 100.00 100.00 1.21e-44 . . . . 4635 2 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'mSin3A PAH2 Domain' common 4635 2 'mSin3A PAH2 Domain' abbreviation 4635 2 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 295 SER . 4635 2 2 296 LEU . 4635 2 3 297 GLN . 4635 2 4 298 ASN . 4635 2 5 299 ASN . 4635 2 6 300 GLN . 4635 2 7 301 PRO . 4635 2 8 302 VAL . 4635 2 9 303 GLU . 4635 2 10 304 PHE . 4635 2 11 305 ASN . 4635 2 12 306 HIS . 4635 2 13 307 ALA . 4635 2 14 308 ILE . 4635 2 15 309 ASN . 4635 2 16 310 TYR . 4635 2 17 311 VAL . 4635 2 18 312 ASN . 4635 2 19 313 LYS . 4635 2 20 314 ILE . 4635 2 21 315 LYS . 4635 2 22 316 ASN . 4635 2 23 317 ARG . 4635 2 24 318 PHE . 4635 2 25 319 GLN . 4635 2 26 320 GLY . 4635 2 27 321 GLN . 4635 2 28 322 PRO . 4635 2 29 323 ASP . 4635 2 30 324 ILE . 4635 2 31 325 TYR . 4635 2 32 326 LYS . 4635 2 33 327 ALA . 4635 2 34 328 PHE . 4635 2 35 329 LEU . 4635 2 36 330 GLU . 4635 2 37 331 ILE . 4635 2 38 332 LEU . 4635 2 39 333 HIS . 4635 2 40 334 THR . 4635 2 41 335 TYR . 4635 2 42 336 GLN . 4635 2 43 337 LYS . 4635 2 44 338 GLU . 4635 2 45 339 GLN . 4635 2 46 340 ARG . 4635 2 47 341 ASN . 4635 2 48 342 ALA . 4635 2 49 343 LYS . 4635 2 50 344 GLU . 4635 2 51 345 ALA . 4635 2 52 346 GLY . 4635 2 53 347 GLY . 4635 2 54 348 ASN . 4635 2 55 349 TYR . 4635 2 56 350 THR . 4635 2 57 351 PRO . 4635 2 58 352 ALA . 4635 2 59 353 LEU . 4635 2 60 354 THR . 4635 2 61 355 GLU . 4635 2 62 356 GLN . 4635 2 63 357 GLU . 4635 2 64 358 VAL . 4635 2 65 359 TYR . 4635 2 66 360 ALA . 4635 2 67 361 GLN . 4635 2 68 362 VAL . 4635 2 69 363 ALA . 4635 2 70 364 ARG . 4635 2 71 365 LEU . 4635 2 72 366 PHE . 4635 2 73 367 LYS . 4635 2 74 368 ASN . 4635 2 75 369 GLN . 4635 2 76 370 GLU . 4635 2 77 371 ASP . 4635 2 78 372 LEU . 4635 2 79 373 LEU . 4635 2 80 374 SER . 4635 2 81 375 GLU . 4635 2 82 376 PHE . 4635 2 83 377 GLY . 4635 2 84 378 GLN . 4635 2 85 379 PHE . 4635 2 86 380 LEU . 4635 2 87 381 PRO . 4635 2 88 382 ASP . 4635 2 89 383 ALA . 4635 2 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . SER 1 1 4635 2 . LEU 2 2 4635 2 . GLN 3 3 4635 2 . ASN 4 4 4635 2 . ASN 5 5 4635 2 . GLN 6 6 4635 2 . PRO 7 7 4635 2 . VAL 8 8 4635 2 . GLU 9 9 4635 2 . PHE 10 10 4635 2 . ASN 11 11 4635 2 . HIS 12 12 4635 2 . ALA 13 13 4635 2 . ILE 14 14 4635 2 . ASN 15 15 4635 2 . TYR 16 16 4635 2 . VAL 17 17 4635 2 . ASN 18 18 4635 2 . LYS 19 19 4635 2 . ILE 20 20 4635 2 . LYS 21 21 4635 2 . ASN 22 22 4635 2 . ARG 23 23 4635 2 . PHE 24 24 4635 2 . GLN 25 25 4635 2 . GLY 26 26 4635 2 . GLN 27 27 4635 2 . PRO 28 28 4635 2 . ASP 29 29 4635 2 . ILE 30 30 4635 2 . TYR 31 31 4635 2 . LYS 32 32 4635 2 . ALA 33 33 4635 2 . PHE 34 34 4635 2 . LEU 35 35 4635 2 . GLU 36 36 4635 2 . ILE 37 37 4635 2 . LEU 38 38 4635 2 . HIS 39 39 4635 2 . THR 40 40 4635 2 . TYR 41 41 4635 2 . GLN 42 42 4635 2 . LYS 43 43 4635 2 . GLU 44 44 4635 2 . GLN 45 45 4635 2 . ARG 46 46 4635 2 . ASN 47 47 4635 2 . ALA 48 48 4635 2 . LYS 49 49 4635 2 . GLU 50 50 4635 2 . ALA 51 51 4635 2 . GLY 52 52 4635 2 . GLY 53 53 4635 2 . ASN 54 54 4635 2 . TYR 55 55 4635 2 . THR 56 56 4635 2 . PRO 57 57 4635 2 . ALA 58 58 4635 2 . LEU 59 59 4635 2 . THR 60 60 4635 2 . GLU 61 61 4635 2 . GLN 62 62 4635 2 . GLU 63 63 4635 2 . VAL 64 64 4635 2 . TYR 65 65 4635 2 . ALA 66 66 4635 2 . GLN 67 67 4635 2 . VAL 68 68 4635 2 . ALA 69 69 4635 2 . ARG 70 70 4635 2 . LEU 71 71 4635 2 . PHE 72 72 4635 2 . LYS 73 73 4635 2 . ASN 74 74 4635 2 . GLN 75 75 4635 2 . GLU 76 76 4635 2 . ASP 77 77 4635 2 . LEU 78 78 4635 2 . LEU 79 79 4635 2 . SER 80 80 4635 2 . GLU 81 81 4635 2 . PHE 82 82 4635 2 . GLY 83 83 4635 2 . GLN 84 84 4635 2 . PHE 85 85 4635 2 . LEU 86 86 4635 2 . PRO 87 87 4635 2 . ASP 88 88 4635 2 . ALA 89 89 4635 2 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 4635 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $MAD1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4635 1 2 2 $SIN3A . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4635 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 4635 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 2 $SIN3A . 'recombinant technology' 'Escherichia coli' 'E. coli' . . Escherichia coli BL21(DE3) . . . . . . . . . . . . . . . pET-24a(+) . . . . . . 4635 1 2 1 $MAD1 . 'chemical synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4635 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 4635 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'MAD1 SID domain' . . . 1 $MAD1 . . 1.0 . . mM . . . . 4635 1 2 'mSin3A PAH2 Domain' [U-15N] . . 2 $SIN3A . . 1.0 . . mM . . . . 4635 1 3 H2O . . . . . . . 90 . . % . . . . 4635 1 4 D2O . . . . . . . 10 . . % . . . . 4635 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 4635 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'MAD1 SID domain' . . . 1 $MAD1 . . 1.6 . . mM . . . . 4635 2 2 'mSin3A PAH2 Domain' '[U-15N; U-13C]' . . 2 $SIN3A . . 1.6 . . mM . . . . 4635 2 3 H2O . . . . . . . 90 . . % . . . . 4635 2 4 D2O . . . . . . . 10 . . % . . . . 4635 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 4635 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'MAD1 SID domain' . . . 1 $MAD1 . . 1.6 . . mM . . . . 4635 3 2 'mSin3A PAH2 Domain' '[U-15N; U-13C]' . . 2 $SIN3A . . 1.6 . . mM . . . . 4635 3 3 H2O . . . . . . . 90 . . % . . . . 4635 3 4 D2O . . . . . . . 10 . . % . . . . 4635 3 5 'phosphate buffer' . . . . . . . 20 . . mM . . . . 4635 3 6 NaN3 . . . . . . . 0.2 . . % . . . . 4635 3 stop_ save_ save_sample_4 _Sample.Sf_category sample _Sample.Sf_framecode sample_4 _Sample.Entry_ID 4635 _Sample.ID 4 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'MAD1 SID domain' . . . 1 $MAD1 . . 1.6 . . mM . . . . 4635 4 2 'mSin3A PAH2 Domain' '[U-15N; U-13C]' . . 2 $SIN3A . . 1.6 . . mM . . . . 4635 4 3 D2O . . . . . . . 100 . . % . . . . 4635 4 4 'phosphate buffer' . . . . . . . 20 . . mM . . . . 4635 4 5 NaN3 . . . . . . . 0.2 . . % . . . . 4635 4 stop_ save_ ####################### # Sample conditions # ####################### save_sample_cond_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_cond_1 _Sample_condition_list.Entry_ID 4635 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 6.0 . pH 4635 1 temperature 300 . K 4635 1 'ionic strength' 20 . mM 4635 1 pressure 1 . atm 4635 1 stop_ save_ ############################ # Computer software used # ############################ save_FELIX _Software.Sf_category software _Software.Sf_framecode FELIX _Software.Entry_ID 4635 _Software.ID 1 _Software.Name FELIX _Software.Version 98 _Software.Details 'Molecular Simulations' loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 4635 1 'data analysis' 4635 1 stop_ save_ save_DYANA _Software.Sf_category software _Software.Sf_framecode DYANA _Software.Entry_ID 4635 _Software.ID 2 _Software.Name DYANA _Software.Version 1.5 _Software.Details 'Guntert, Wuthrich' loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 4635 2 stop_ save_ save_CNS _Software.Sf_category software _Software.Sf_framecode CNS _Software.Entry_ID 4635 _Software.ID 3 _Software.Name CNS _Software.Version 1.0 _Software.Details Brunger loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 4635 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 4635 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode spectrometer_list _NMR_spectrometer_list.Entry_ID 4635 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Varian INOVA . 500 . . . 4635 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 4635 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D 15N-separated NOESY' . . . . . . . . . . . . . . . . 1 $sample_cond_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 4635 1 2 HNHA . . . . . . . . . . . . . . . . 1 $sample_cond_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 4635 1 3 '2D 13C,15N-double-half-filtered NOESY' . . . . . . . . . . . . . . . . 1 $sample_cond_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 4635 1 4 '2D 13C-double-half-filtered NOESY' . . . . . . . . . . . . . . . . 1 $sample_cond_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 4635 1 5 '3D 13C-separated_NOESY' . . . . . . . . . . . . . . . . 1 $sample_cond_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 4635 1 6 '3D HACAHB' . . . . . . . . . . . . . . . . 1 $sample_cond_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 4635 1 7 '3D HNHB' . . . . . . . . . . . . . . . . 1 $sample_cond_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 4635 1 stop_ save_ ######################## # Coupling constants # ######################## save_JHNHA _Coupling_constant_list.Sf_category coupling_constants _Coupling_constant_list.Sf_framecode JHNHA _Coupling_constant_list.Entry_ID 4635 _Coupling_constant_list.ID 1 _Coupling_constant_list.Sample_condition_list_ID 1 _Coupling_constant_list.Sample_condition_list_label $sample_cond_1 _Coupling_constant_list.Spectrometer_frequency_1H 500 _Coupling_constant_list.Details . _Coupling_constant_list.Text_data_format . _Coupling_constant_list.Text_data . loop_ _Coupling_constant_experiment.Experiment_ID _Coupling_constant_experiment.Experiment_name _Coupling_constant_experiment.Sample_ID _Coupling_constant_experiment.Sample_label _Coupling_constant_experiment.Sample_state _Coupling_constant_experiment.Entry_ID _Coupling_constant_experiment.Coupling_constant_list_ID . . 1 $sample_1 . 4635 1 stop_ loop_ _Coupling_constant.ID _Coupling_constant.Code _Coupling_constant.Assembly_atom_ID_1 _Coupling_constant.Entity_assembly_ID_1 _Coupling_constant.Entity_ID_1 _Coupling_constant.Comp_index_ID_1 _Coupling_constant.Seq_ID_1 _Coupling_constant.Comp_ID_1 _Coupling_constant.Atom_ID_1 _Coupling_constant.Atom_type_1 _Coupling_constant.Atom_isotope_number_1 _Coupling_constant.Ambiguity_code_1 _Coupling_constant.Assembly_atom_ID_2 _Coupling_constant.Entity_assembly_ID_2 _Coupling_constant.Entity_ID_2 _Coupling_constant.Comp_index_ID_2 _Coupling_constant.Seq_ID_2 _Coupling_constant.Comp_ID_2 _Coupling_constant.Atom_ID_2 _Coupling_constant.Atom_type_2 _Coupling_constant.Atom_isotope_number_2 _Coupling_constant.Ambiguity_code_2 _Coupling_constant.Val _Coupling_constant.Val_min _Coupling_constant.Val_max _Coupling_constant.Val_err _Coupling_constant.Resonance_ID_1 _Coupling_constant.Resonance_ID_2 _Coupling_constant.Auth_entity_assembly_ID_1 _Coupling_constant.Auth_seq_ID_1 _Coupling_constant.Auth_comp_ID_1 _Coupling_constant.Auth_atom_ID_1 _Coupling_constant.Auth_entity_assembly_ID_2 _Coupling_constant.Auth_seq_ID_2 _Coupling_constant.Auth_comp_ID_2 _Coupling_constant.Auth_atom_ID_2 _Coupling_constant.Details _Coupling_constant.Entry_ID _Coupling_constant.Coupling_constant_list_ID 1 3JHNHA . 2 2 3 3 GLN H . . . . 2 2 3 3 GLN HA . . . 5.82 . . 0.40 . . . . . . . . . . . 4635 1 2 3JHNHA . 2 2 4 4 ASN H . . . . 2 2 4 4 ASN HA . . . 7.64 . . 0.40 . . . . . . . . . . . 4635 1 3 3JHNHA . 2 2 5 5 ASN H . . . . 2 2 5 5 ASN HA . . . 6.91 . . 0.40 . . . . . . . . . . . 4635 1 4 3JHNHA . 2 2 6 6 GLN H . . . . 2 2 6 6 GLN HA . . . 7.23 . . 0.40 . . . . . . . . . . . 4635 1 5 3JHNHA . 2 2 8 8 VAL H . . . . 2 2 8 8 VAL HA . . . 4.76 . . 0.40 . . . . . . . . . . . 4635 1 6 3JHNHA . 2 2 9 9 GLU H . . . . 2 2 9 9 GLU HA . . . 4.83 . . 0.40 . . . . . . . . . . . 4635 1 7 3JHNHA . 2 2 10 10 PHE H . . . . 2 2 10 10 PHE HA . . . 4.40 . . 0.40 . . . . . . . . . . . 4635 1 8 3JHNHA . 2 2 11 11 ASN H . . . . 2 2 11 11 ASN HA . . . 4.00 . . 0.40 . . . . . . . . . . . 4635 1 9 3JHNHA . 2 2 13 13 ALA H . . . . 2 2 13 13 ALA HA . . . 4.93 . . 0.40 . . . . . . . . . . . 4635 1 10 3JHNHA . 2 2 14 14 ILE H . . . . 2 2 14 14 ILE HA . . . 3.27 . . 0.40 . . . . . . . . . . . 4635 1 11 3JHNHA . 2 2 15 15 ASN H . . . . 2 2 15 15 ASN HA . . . 3.77 . . 0.40 . . . . . . . . . . . 4635 1 12 3JHNHA . 2 2 16 16 TYR H . . . . 2 2 16 16 TYR HA . . . 4.50 . . 0.40 . . . . . . . . . . . 4635 1 13 3JHNHA . 2 2 17 17 VAL H . . . . 2 2 17 17 VAL HA . . . 4.27 . . 0.40 . . . . . . . . . . . 4635 1 14 3JHNHA . 2 2 18 18 ASN H . . . . 2 2 18 18 ASN HA . . . 3.83 . . 0.40 . . . . . . . . . . . 4635 1 15 3JHNHA . 2 2 20 20 ILE H . . . . 2 2 20 20 ILE HA . . . 4.29 . . 0.40 . . . . . . . . . . . 4635 1 16 3JHNHA . 2 2 21 21 LYS H . . . . 2 2 21 21 LYS HA . . . 2.98 . . 0.40 . . . . . . . . . . . 4635 1 17 3JHNHA . 2 2 22 22 ASN H . . . . 2 2 22 22 ASN HA . . . 4.99 . . 0.40 . . . . . . . . . . . 4635 1 18 3JHNHA . 2 2 23 23 ARG H . . . . 2 2 23 23 ARG HA . . . 3.33 . . 0.40 . . . . . . . . . . . 4635 1 19 3JHNHA . 2 2 24 24 PHE H . . . . 2 2 24 24 PHE HA . . . 8.75 . . 0.40 . . . . . . . . . . . 4635 1 20 3JHNHA . 2 2 25 25 GLN H . . . . 2 2 25 25 GLN HA . . . 2.38 . . 0.40 . . . . . . . . . . . 4635 1 21 3JHNHA . 2 2 27 27 GLN H . . . . 2 2 27 27 GLN HA . . . 8.96 . . 0.40 . . . . . . . . . . . 4635 1 22 3JHNHA . 2 2 29 29 ASP H . . . . 2 2 29 29 ASP HA . . . 4.78 . . 0.40 . . . . . . . . . . . 4635 1 23 3JHNHA . 2 2 30 30 ILE H . . . . 2 2 30 30 ILE HA . . . 5.52 . . 0.40 . . . . . . . . . . . 4635 1 24 3JHNHA . 2 2 31 31 TYR H . . . . 2 2 31 31 TYR HA . . . 5.10 . . 0.40 . . . . . . . . . . . 4635 1 25 3JHNHA . 2 2 32 32 LYS H . . . . 2 2 32 32 LYS HA . . . 4.02 . . 0.40 . . . . . . . . . . . 4635 1 26 3JHNHA . 2 2 33 33 ALA H . . . . 2 2 33 33 ALA HA . . . 3.54 . . 0.40 . . . . . . . . . . . 4635 1 27 3JHNHA . 2 2 34 34 PHE H . . . . 2 2 34 34 PHE HA . . . 3.57 . . 0.40 . . . . . . . . . . . 4635 1 28 3JHNHA . 2 2 35 35 LEU H . . . . 2 2 35 35 LEU HA . . . 3.81 . . 0.40 . . . . . . . . . . . 4635 1 29 3JHNHA . 2 2 36 36 GLU H . . . . 2 2 36 36 GLU HA . . . 4.08 . . 0.40 . . . . . . . . . . . 4635 1 30 3JHNHA . 2 2 37 37 ILE H . . . . 2 2 37 37 ILE HA . . . 4.39 . . 0.40 . . . . . . . . . . . 4635 1 31 3JHNHA . 2 2 38 38 LEU H . . . . 2 2 38 38 LEU HA . . . 4.13 . . 0.40 . . . . . . . . . . . 4635 1 32 3JHNHA . 2 2 39 39 HIS H . . . . 2 2 39 39 HIS HA . . . 3.86 . . 0.40 . . . . . . . . . . . 4635 1 33 3JHNHA . 2 2 40 40 THR H . . . . 2 2 40 40 THR HA . . . 4.62 . . 0.40 . . . . . . . . . . . 4635 1 34 3JHNHA . 2 2 41 41 TYR H . . . . 2 2 41 41 TYR HA . . . 3.57 . . 0.40 . . . . . . . . . . . 4635 1 35 3JHNHA . 2 2 42 42 GLN H . . . . 2 2 42 42 GLN HA . . . 3.48 . . 0.40 . . . . . . . . . . . 4635 1 36 3JHNHA . 2 2 43 43 LYS H . . . . 2 2 43 43 LYS HA . . . 4.37 . . 0.40 . . . . . . . . . . . 4635 1 37 3JHNHA . 2 2 46 46 ARG H . . . . 2 2 46 46 ARG HA . . . 4.96 . . 0.40 . . . . . . . . . . . 4635 1 38 3JHNHA . 2 2 47 47 ASN H . . . . 2 2 47 47 ASN HA . . . 4.02 . . 0.40 . . . . . . . . . . . 4635 1 39 3JHNHA . 2 2 48 48 ALA H . . . . 2 2 48 48 ALA HA . . . 3.15 . . 0.40 . . . . . . . . . . . 4635 1 40 3JHNHA . 2 2 49 49 LYS H . . . . 2 2 49 49 LYS HA . . . 5.32 . . 0.40 . . . . . . . . . . . 4635 1 41 3JHNHA . 2 2 54 54 ASN H . . . . 2 2 54 54 ASN HA . . . 6.91 . . 0.40 . . . . . . . . . . . 4635 1 42 3JHNHA . 2 2 55 55 TYR H . . . . 2 2 55 55 TYR HA . . . 6.83 . . 0.40 . . . . . . . . . . . 4635 1 43 3JHNHA . 2 2 56 56 THR H . . . . 2 2 56 56 THR HA . . . 8.14 . . 0.40 . . . . . . . . . . . 4635 1 44 3JHNHA . 2 2 59 59 LEU H . . . . 2 2 59 59 LEU HA . . . 6.80 . . 0.40 . . . . . . . . . . . 4635 1 45 3JHNHA . 2 2 60 60 THR H . . . . 2 2 60 60 THR HA . . . 8.00 . . 0.40 . . . . . . . . . . . 4635 1 46 3JHNHA . 2 2 61 61 GLU H . . . . 2 2 61 61 GLU HA . . . 3.15 . . 0.40 . . . . . . . . . . . 4635 1 47 3JHNHA . 2 2 62 62 GLN H . . . . 2 2 62 62 GLN HA . . . 4.13 . . 0.40 . . . . . . . . . . . 4635 1 48 3JHNHA . 2 2 63 63 GLU H . . . . 2 2 63 63 GLU HA . . . 6.02 . . 0.40 . . . . . . . . . . . 4635 1 49 3JHNHA . 2 2 64 64 VAL H . . . . 2 2 64 64 VAL HA . . . 4.41 . . 0.40 . . . . . . . . . . . 4635 1 50 3JHNHA . 2 2 65 65 TYR H . . . . 2 2 65 65 TYR HA . . . 3.31 . . 0.40 . . . . . . . . . . . 4635 1 51 3JHNHA . 2 2 66 66 ALA H . . . . 2 2 66 66 ALA HA . . . 4.03 . . 0.40 . . . . . . . . . . . 4635 1 52 3JHNHA . 2 2 67 67 GLN H . . . . 2 2 67 67 GLN HA . . . 5.27 . . 0.40 . . . . . . . . . . . 4635 1 53 3JHNHA . 2 2 68 68 VAL H . . . . 2 2 68 68 VAL HA . . . 5.21 . . 0.40 . . . . . . . . . . . 4635 1 54 3JHNHA . 2 2 69 69 ALA H . . . . 2 2 69 69 ALA HA . . . 2.76 . . 0.80 . . . . . . . . . . . 4635 1 55 3JHNHA . 2 2 70 70 ARG H . . . . 2 2 70 70 ARG HA . . . 5.30 . . 0.40 . . . . . . . . . . . 4635 1 56 3JHNHA . 2 2 71 71 LEU H . . . . 2 2 71 71 LEU HA . . . 4.41 . . 0.40 . . . . . . . . . . . 4635 1 57 3JHNHA . 2 2 72 72 PHE H . . . . 2 2 72 72 PHE HA . . . 7.56 . . 0.40 . . . . . . . . . . . 4635 1 58 3JHNHA . 2 2 73 73 LYS H . . . . 2 2 73 73 LYS HA . . . 2.44 . . 0.40 . . . . . . . . . . . 4635 1 59 3JHNHA . 2 2 74 74 ASN H . . . . 2 2 74 74 ASN HA . . . 7.15 . . 0.40 . . . . . . . . . . . 4635 1 60 3JHNHA . 2 2 75 75 GLN H . . . . 2 2 75 75 GLN HA . . . 8.56 . . 0.40 . . . . . . . . . . . 4635 1 61 3JHNHA . 2 2 76 76 GLU H . . . . 2 2 76 76 GLU HA . . . 2.36 . . 0.80 . . . . . . . . . . . 4635 1 62 3JHNHA . 2 2 77 77 ASP H . . . . 2 2 77 77 ASP HA . . . 5.20 . . 0.40 . . . . . . . . . . . 4635 1 63 3JHNHA . 2 2 78 78 LEU H . . . . 2 2 78 78 LEU HA . . . 2.62 . . 0.80 . . . . . . . . . . . 4635 1 64 3JHNHA . 2 2 79 79 LEU H . . . . 2 2 79 79 LEU HA . . . 5.01 . . 0.40 . . . . . . . . . . . 4635 1 65 3JHNHA . 2 2 80 80 SER H . . . . 2 2 80 80 SER HA . . . 3.42 . . 0.40 . . . . . . . . . . . 4635 1 66 3JHNHA . 2 2 81 81 GLU H . . . . 2 2 81 81 GLU HA . . . 3.92 . . 0.80 . . . . . . . . . . . 4635 1 67 3JHNHA . 2 2 82 82 PHE H . . . . 2 2 82 82 PHE HA . . . 3.02 . . 0.40 . . . . . . . . . . . 4635 1 68 3JHNHA . 2 2 84 84 GLN H . . . . 2 2 84 84 GLN HA . . . 5.22 . . 0.40 . . . . . . . . . . . 4635 1 69 3JHNHA . 2 2 85 85 PHE H . . . . 2 2 85 85 PHE HA . . . 8.55 . . 0.40 . . . . . . . . . . . 4635 1 70 3JHNHA . 2 2 86 86 LEU H . . . . 2 2 86 86 LEU HA . . . 8.05 . . 0.40 . . . . . . . . . . . 4635 1 71 3JHNHA . 2 2 88 88 ASP H . . . . 2 2 88 88 ASP HA . . . 7.48 . . 0.40 . . . . . . . . . . . 4635 1 72 3JHNHA . 2 2 89 89 ALA H . . . . 2 2 89 89 ALA HA . . . 6.47 . . 0.40 . . . . . . . . . . . 4635 1 stop_ save_