data_6558 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Structure of the FBP11WW1 domain ; _BMRB_accession_number 6558 _BMRB_flat_file_name bmr6558.str _Entry_type original _Submission_date 2005-03-18 _Accession_date 2005-03-31 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details . loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Pires J. R. . 2 Parthier C. . . 3 Aido-Machado R. . . 4 Wiedemann U. . . 5 Otte L. . . 6 Boehm G. . . 7 Rudolph R. . . 8 Oschkinat H. . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 2 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 359 "13C chemical shifts" 129 "15N chemical shifts" 44 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2005-08-22 original author . stop_ loop_ _Related_BMRB_accession_number _Relationship 6559 'complexed to the peptide APPTPPPLPP' stop_ _Original_release_date 2005-08-22 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'Structural basis for APPTPPPLPP peptide recognition by the FBP11WW1 domain' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 15811376 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Pires J. R. . 2 Parthier C. . . 3 Aido-Machado R. . . 4 Wiedemann U. . . 5 Otte L. . . 6 Boehm G. . . 7 Rudolph R. . . 8 Oschkinat H. . . stop_ _Journal_abbreviation 'J. Mol. Biol.' _Journal_volume 348 _Journal_issue 2 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 399 _Page_last 408 _Year 2005 _Details . loop_ _Keyword 'WW domain' 'Class II' 'Proline-rich peptides' 'protein-protein interactions' stop_ save_ ################################## # Molecular system description # ################################## save_system_FBP11WW1 _Saveframe_category molecular_system _Mol_system_name 'Formin-binding protein 3' _Abbreviation_common FBP11WW1 _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'Formin-binding protein 3' $FBP11WW1 stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state monomer _System_paramagnetic no _System_thiol_state 'not present' _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_FBP11WW1 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common 'Formin-binding protein 3' _Abbreviation_common FBP11WW1 _Molecular_mass . _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 41 _Mol_residue_sequence ; GSRRASVGSAKSMWTEHKSP DGRTYYYNTETKQSTWEKPD D ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 4 GLY 2 5 SER 3 6 ARG 4 7 ARG 5 8 ALA 6 9 SER 7 10 VAL 8 11 GLY 9 12 SER 10 13 ALA 11 14 LYS 12 15 SER 13 16 MET 14 17 TRP 15 18 THR 16 19 GLU 17 20 HIS 18 21 LYS 19 22 SER 20 23 PRO 21 24 ASP 22 25 GLY 23 26 ARG 24 27 THR 25 28 TYR 26 29 TYR 27 30 TYR 28 31 ASN 29 32 THR 30 33 GLU 31 34 THR 32 35 LYS 33 36 GLN 34 37 SER 35 38 THR 36 39 TRP 37 40 GLU 38 41 LYS 39 42 PRO 40 43 ASP 41 44 ASP stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-01-28 loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value BMRB 6721 FBP11_WW1 68.29 30 100.00 100.00 6.18e-11 PDB 1YWI "Structure Of The Fbp11ww1 Domain Complexed To The Peptide Apptppplpp" 100.00 41 100.00 100.00 1.95e-20 PDB 1YWJ "Structure Of The Fbp11ww1 Domain" 100.00 41 100.00 100.00 1.95e-20 PDB 1ZR7 "Solution Structure Of The First Ww Domain Of Fbp11" 68.29 30 100.00 100.00 6.18e-11 PDB 2DYF "Solution Structure Of The First Ww Domain Of Fbp11 HYPA (Fbp11 Ww1) Complexed With A Pl (Pplp) Motif Peptide Ligand" 68.29 30 100.00 100.00 6.18e-11 DBJ BAB15016 "unnamed protein product [Homo sapiens]" 78.05 323 100.00 100.00 7.76e-14 GB AAB93495 "Fas-ligand associated factor 1 [Homo sapiens]" 78.05 349 100.00 100.00 1.48e-13 GB AAC27501 "huntingtin-interacting protein HYPA/FBP11 [Homo sapiens]" 78.05 423 100.00 100.00 1.96e-13 GB AAC27502 "huntingtin-interacting protein HYPA/FBP11 [Homo sapiens]" 78.05 167 100.00 100.00 8.00e-14 GB AAC27506 "huntingtin-interacting protein HYPA/FBP11 [Homo sapiens]" 78.05 452 100.00 100.00 2.79e-13 GB AAH11788 "PRPF40A protein, partial [Homo sapiens]" 78.05 411 100.00 100.00 1.90e-13 REF NP_001231502 "pre-mRNA-processing factor 40 homolog A [Sus scrofa]" 78.05 957 100.00 100.00 4.92e-13 REF NP_060362 "pre-mRNA-processing factor 40 homolog A [Homo sapiens]" 78.05 930 100.00 100.00 4.54e-13 REF XP_001916024 "PREDICTED: pre-mRNA-processing factor 40 homolog A isoformX1 [Equus caballus]" 78.05 994 100.00 100.00 5.01e-13 REF XP_002685399 "PREDICTED: pre-mRNA-processing factor 40 homolog A isoform X13 [Bos taurus]" 78.05 929 100.00 100.00 5.14e-13 REF XP_002749482 "PREDICTED: pre-mRNA-processing factor 40 homolog A isoform X2 [Callithrix jacchus]" 78.05 994 100.00 100.00 4.42e-13 SP O75400 "RecName: Full=Pre-mRNA-processing factor 40 homolog A; AltName: Full=Fas ligand-associated factor 1; AltName: Full=Formin-bindi" 78.05 957 100.00 100.00 5.32e-13 TPG DAA32724 "TPA: formin binding protein 3-like [Bos taurus]" 78.05 929 100.00 100.00 5.14e-13 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $FBP11WW1 Human 9606 Eukaryota Metazoa Homo sapiens stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name $FBP11WW1 'recombinant technology' . . . . . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $FBP11WW1 1.8 mM '[U-15N; U-13C]' 'phosphate buffer' 10 mM . Nacl 100 mM . DTT 0.1 mM . EDTA 0.1 mM . H2O 90 % . D2O 10 % . stop_ save_ save_sample_2 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $FBP11WW1 1.8 mM '[U-15N; U-13C]' 'phosphate buffer' 10 mM . Nacl 100 mM . DTT 0.1 mM . EDTA 0.1 mM . D2O 100 % . stop_ save_ save_sample_3 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $FBP11WW1 1.8 mM [U-15N] 'phosphate buffer' 10 mM . Nacl 100 mM . DTT 0.1 mM . EDTA 0.1 mM . H2O 90 % . D2O 10 % . stop_ save_ save_sample_4 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $FBP11WW1 1.8 mM . 'phosphate buffer' 10 mM . Nacl 100 mM . DTT 0.1 mM . EDTA 0.1 mM . H2O 90 % . D2O 10 % . stop_ save_ ############################ # Computer software used # ############################ save_CNS _Saveframe_category software _Name CNS _Version 1.1 loop_ _Task refinement stop_ _Details . save_ save_XWINNMR _Saveframe_category software _Name XWINNMR _Version 3.2 loop_ _Task 'collection, processing' stop_ _Details 'Bruker AG' save_ save_Sparky _Saveframe_category software _Name Sparky _Version 3.1 loop_ _Task 'data analysis' stop_ _Details ; Goddard, T.D., Keneller, D.G., University of California San Francisco. ; save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DRX _Field_strength 600 _Details . save_ ############################# # NMR applied experiments # ############################# save_triple-resonance_1 _Saveframe_category NMR_applied_experiment _Experiment_name triple-resonance _Sample_label . save_ save_3D_13C-separated_NOESY_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 13C-separated NOESY' _Sample_label . save_ save_3D_15N-separated_NOESY_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 15N-separated NOESY' _Sample_label . save_ save_2D_NOESY_4 _Saveframe_category NMR_applied_experiment _Experiment_name '2D NOESY' _Sample_label . save_ save_2D_TOCSY_5 _Saveframe_category NMR_applied_experiment _Experiment_name '2D TOCSY' _Sample_label . save_ save_NMR_spec_expt__0_1 _Saveframe_category NMR_applied_experiment _Experiment_name triple-resonance _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spec_expt__0_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 13C-separated NOESY' _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spec_expt__0_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 15N-separated NOESY' _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spec_expt__0_4 _Saveframe_category NMR_applied_experiment _Experiment_name '2D NOESY' _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spec_expt__0_5 _Saveframe_category NMR_applied_experiment _Experiment_name '2D TOCSY' _BMRB_pulse_sequence_accession_number . _Details . save_ ####################### # Sample conditions # ####################### save_sample_cond_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 6.0 . pH temperature 298 . K 'ionic strength' 100 . mM pressure 1 . atm stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis . H 1 . ppm . . . . . . . C 13 . ppm . . . . . . . N 15 . ppm . . . . . . stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_chemical_shift_set_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_3 stop_ _Sample_conditions_label $sample_cond_1 _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'Formin-binding protein 3' _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 . 1 GLY HA2 H 3.904 0.0 . 2 . 2 SER H H 8.665 0.0 . 3 . 2 SER N N 115.890 0.0 . 4 . 2 SER HA H 4.507 0.0 . 5 . 2 SER HB2 H 3.858 0.0 . 6 . 3 ARG HE H 7.164 0.0 . 7 . 3 ARG H H 8.531 0.0 . 8 . 3 ARG N N 123.495 0.0 . 9 . 3 ARG NE N 134.337 0.0 . 10 . 3 ARG HA H 4.343 0.0 . 11 . 3 ARG HB2 H 1.839 0.0 . 12 . 3 ARG HB3 H 1.772 0.0 . 13 . 3 ARG HD2 H 3.191 0.0 . 14 . 3 ARG HG2 H 1.630 0.0 . 15 . 4 ARG HE H 7.164 0.0 . 16 . 4 ARG H H 8.432 0.0 . 17 . 4 ARG N N 123.215 0.0 . 18 . 4 ARG NE N 134.337 0.0 . 19 . 4 ARG HA H 4.309 0.0 . 20 . 4 ARG HB2 H 1.829 0.0 . 21 . 4 ARG HB3 H 1.749 0.0 . 22 . 4 ARG HD2 H 3.187 0.0 . 23 . 4 ARG HG2 H 1.631 0.0 . 24 . 5 ALA H H 8.392 0.0 . 25 . 5 ALA N N 125.754 0.0 . 26 . 5 ALA HA H 4.316 0.0 . 27 . 5 ALA HB H 1.388 0.0 . 28 . 6 SER H H 8.330 0.0 . 29 . 6 SER N N 115.641 0.0 . 30 . 6 SER HA H 4.463 0.0 . 31 . 6 SER HB2 H 3.865 0.0 . 32 . 7 VAL H H 8.203 0.0 . 33 . 7 VAL N N 121.791 0.0 . 34 . 7 VAL HA H 4.154 0.0 . 35 . 7 VAL HB H 2.103 0.0 . 36 . 7 VAL HG1 H 0.940 0.0 . 37 . 8 GLY H H 8.477 0.0 . 38 . 8 GLY N N 112.501 0.0 . 39 . 8 GLY HA2 H 3.988 0.0 . 40 . 9 SER H H 8.214 0.0 . 41 . 9 SER N N 115.866 0.0 . 42 . 9 SER HA H 4.458 0.0 . 43 . 9 SER HB2 H 3.867 0.0 . 44 . 10 ALA H H 8.408 0.0 . 45 . 10 ALA N N 126.042 0.0 . 46 . 10 ALA HA H 4.323 0.0 . 47 . 10 ALA HB H 1.400 0.0 . 48 . 11 LYS H H 8.245 0.0 . 49 . 11 LYS N N 120.067 0.0 . 50 . 11 LYS HA H 4.311 0.0 . 51 . 11 LYS HB2 H 1.847 0.0 . 52 . 11 LYS HB3 H 1.773 0.0 . 53 . 11 LYS HD2 H 1.666 0.0 . 54 . 11 LYS HE2 H 2.989 0.0 . 55 . 11 LYS HG2 H 1.442 0.0 . 56 . 12 SER H H 8.222 0.0 . 57 . 12 SER N N 115.917 0.0 . 58 . 12 SER HA H 4.507 0.0 . 59 . 12 SER HB2 H 4.014 0.0 . 60 . 12 SER HB3 H 3.888 0.0 . 61 . 13 MET H H 8.521 0.0 . 62 . 13 MET N N 122.955 0.0 . 63 . 13 MET HA H 4.505 0.0 . 64 . 13 MET HB2 H 2.021 0.0 . 65 . 13 MET HB3 H 1.823 0.0 . 66 . 13 MET HG2 H 2.509 0.0 . 67 . 13 MET HG3 H 2.360 0.0 . 68 . 13 MET HE H 1.998 0.0 . 69 . 14 TRP HE1 H 10.334 0.0 . 70 . 14 TRP H H 8.130 0.0 . 71 . 14 TRP N N 119.242 0.0 . 72 . 14 TRP NE1 N 129.811 0.0 . 73 . 14 TRP HA H 5.178 0.0 . 74 . 14 TRP HB2 H 3.148 0.0 . 75 . 14 TRP HB3 H 3.044 0.0 . 76 . 14 TRP HD1 H 7.319 0.0 . 77 . 14 TRP HE3 H 7.323 0.0 . 78 . 14 TRP HH2 H 7.023 0.0 . 79 . 14 TRP HZ2 H 7.479 0.0 . 80 . 14 TRP HZ3 H 6.951 0.0 . 81 . 15 THR H H 9.423 0.0 . 82 . 15 THR N N 115.919 0.0 . 83 . 15 THR HA H 4.800 0.0 . 84 . 15 THR HB H 4.206 0.0 . 85 . 15 THR HG2 H 1.279 0.0 . 86 . 16 GLU H H 8.676 0.0 . 87 . 16 GLU N N 124.258 0.0 . 88 . 16 GLU HA H 4.487 0.0 . 89 . 16 GLU HB2 H 1.801 0.0 . 90 . 16 GLU HG2 H 1.987 0.0 . 91 . 17 HIS H H 8.588 0.0 . 92 . 17 HIS N N 122.287 0.0 . 93 . 17 HIS HA H 4.500 0.0 . 94 . 17 HIS HB2 H 2.614 0.0 . 95 . 17 HIS HB3 H 1.276 0.0 . 96 . 17 HIS HD2 H 6.713 0.0 . 97 . 17 HIS HE1 H 8.381 0.0 . 98 . 18 LYS H H 8.325 0.0 . 99 . 18 LYS N N 119.459 0.0 . 100 . 18 LYS HA H 5.158 0.0 . 101 . 18 LYS HB2 H 1.649 0.0 . 102 . 18 LYS HD2 H 1.523 0.0 . 103 . 18 LYS HE2 H 2.904 0.0 . 104 . 18 LYS HG2 H 1.350 0.0 . 105 . 19 SER H H 9.379 0.0 . 106 . 19 SER N N 121.169 0.0 . 107 . 19 SER HB2 H 4.459 0.0 . 108 . 19 SER HB3 H 4.139 0.0 . 109 . 20 PRO HA H 4.338 0.0 . 110 . 20 PRO HB2 H 2.337 0.0 . 111 . 20 PRO HB3 H 1.736 0.0 . 112 . 20 PRO HD2 H 3.635 0.0 . 113 . 20 PRO HD3 H 3.556 0.0 . 114 . 20 PRO HG2 H 1.868 0.0 . 115 . 21 ASP H H 7.850 0.0 . 116 . 21 ASP N N 112.503 0.0 . 117 . 21 ASP HA H 4.630 0.0 . 118 . 21 ASP HB2 H 2.947 0.0 . 119 . 21 ASP HB3 H 2.702 0.0 . 120 . 22 GLY H H 8.343 0.0 . 121 . 22 GLY N N 108.448 0.0 . 122 . 22 GLY HA2 H 4.324 0.0 . 123 . 22 GLY HA3 H 3.634 0.0 . 124 . 23 ARG H H 7.752 0.0 . 125 . 23 ARG N N 121.318 0.0 . 126 . 23 ARG HA H 4.496 0.0 . 127 . 23 ARG HB2 H 2.010 0.0 . 128 . 23 ARG HD2 H 2.795 0.0 . 129 . 23 ARG HG2 H 1.653 0.0 . 130 . 23 ARG HG3 H 1.590 0.0 . 131 . 24 THR H H 8.769 0.0 . 132 . 24 THR N N 120.929 0.0 . 133 . 24 THR HA H 4.886 0.0 . 134 . 24 THR HB H 3.982 0.0 . 135 . 24 THR HG2 H 0.884 0.0 . 136 . 25 TYR H H 8.695 0.0 . 137 . 25 TYR N N 122.537 0.0 . 138 . 25 TYR HA H 4.824 0.0 . 139 . 25 TYR HB2 H 2.402 0.0 . 140 . 25 TYR HD1 H 6.750 0.0 . 141 . 25 TYR HE1 H 6.372 0.0 . 142 . 26 TYR H H 8.965 0.0 . 143 . 26 TYR N N 118.514 0.0 . 144 . 26 TYR HA H 5.291 0.0 . 145 . 26 TYR HB2 H 2.846 0.0 . 146 . 26 TYR HB3 H 2.671 0.0 . 147 . 26 TYR HD1 H 6.794 0.0 . 148 . 26 TYR HE1 H 6.668 0.0 . 149 . 27 TYR H H 9.402 0.0 . 150 . 27 TYR N N 123.917 0.0 . 151 . 27 TYR HA H 5.574 0.0 . 152 . 27 TYR HB2 H 2.678 0.0 . 153 . 27 TYR HD1 H 6.928 0.0 . 154 . 27 TYR HE1 H 6.590 0.0 . 155 . 28 ASN H H 8.205 0.0 . 156 . 28 ASN N N 130.256 0.0 . 157 . 28 ASN ND2 N 111.696 0.0 . 158 . 28 ASN HA H 4.418 0.0 . 159 . 28 ASN HB2 H 2.275 0.0 . 160 . 28 ASN HB3 H 0.101 0.0 . 161 . 28 ASN HD21 H 6.662 0.0 . 162 . 29 THR H H 8.354 0.0 . 163 . 29 THR N N 116.846 0.0 . 164 . 29 THR HA H 3.726 0.0 . 165 . 29 THR HB H 4.299 0.0 . 166 . 29 THR HG2 H 1.385 0.0 . 167 . 30 GLU H H 8.155 0.0 . 168 . 30 GLU N N 120.709 0.0 . 169 . 30 GLU HA H 4.277 0.0 . 170 . 30 GLU HB2 H 2.054 0.0 . 171 . 30 GLU HG2 H 2.284 0.0 . 172 . 30 GLU HG3 H 2.181 0.0 . 173 . 31 THR H H 7.775 0.0 . 174 . 31 THR N N 108.999 0.0 . 175 . 31 THR HA H 4.103 0.0 . 176 . 31 THR HB H 4.235 0.0 . 177 . 31 THR HG2 H 0.964 0.0 . 178 . 32 LYS H H 7.967 0.0 . 179 . 32 LYS N N 116.444 0.0 . 180 . 32 LYS HA H 3.627 0.0 . 181 . 32 LYS HB2 H 2.113 0.0 . 182 . 32 LYS HB3 H 2.046 0.0 . 183 . 32 LYS HD2 H 1.608 0.0 . 184 . 32 LYS HE2 H 2.972 0.0 . 185 . 32 LYS HG2 H 1.206 0.0 . 186 . 33 GLN HE21 H 7.579 0.0 . 187 . 33 GLN HE22 H 6.976 0.0 . 188 . 33 GLN H H 7.054 0.0 . 189 . 33 GLN N N 117.820 0.0 . 190 . 33 GLN NE2 N 113.009 0.0 . 191 . 33 GLN HA H 4.422 0.0 . 192 . 33 GLN HB2 H 2.074 0.0 . 193 . 33 GLN HB3 H 1.710 0.0 . 194 . 33 GLN HG2 H 2.337 0.0 . 195 . 34 SER H H 8.530 0.0 . 196 . 34 SER N N 116.284 0.0 . 197 . 34 SER HA H 6.033 0.0 . 198 . 34 SER HB2 H 3.677 0.0 . 199 . 34 SER HB3 H 3.677 0.0 . 200 . 35 THR H H 9.274 0.0 . 201 . 35 THR N N 117.321 0.0 . 202 . 35 THR HA H 4.767 0.0 . 203 . 35 THR HB H 4.244 0.0 . 204 . 35 THR HG2 H 1.076 0.0 . 205 . 36 TRP HE1 H 10.085 0.0 . 206 . 36 TRP H H 8.492 0.0 . 207 . 36 TRP N N 125.067 0.0 . 208 . 36 TRP NE1 N 128.922 0.0 . 209 . 36 TRP HA H 5.032 0.0 . 210 . 36 TRP HB2 H 3.659 0.0 . 211 . 36 TRP HB3 H 3.157 0.0 . 212 . 36 TRP HD1 H 7.375 0.0 . 213 . 36 TRP HE3 H 7.990 0.0 . 214 . 36 TRP HH2 H 7.096 0.0 . 215 . 36 TRP HZ2 H 7.318 0.0 . 216 . 36 TRP HZ3 H 6.947 0.0 . 217 . 37 GLU H H 8.130 0.0 . 218 . 37 GLU N N 119.824 0.0 . 219 . 37 GLU HA H 4.475 0.0 . 220 . 37 GLU HB2 H 1.893 0.0 . 221 . 37 GLU HB3 H 1.788 0.0 . 222 . 37 GLU HG2 H 2.281 0.0 . 223 . 38 LYS H H 8.229 0.0 . 224 . 38 LYS N N 125.774 0.0 . 225 . 38 LYS HA H 3.024 0.0 . 226 . 38 LYS HB2 H 1.378 0.0 . 227 . 38 LYS HB3 H 1.279 0.0 . 228 . 38 LYS HD2 H 1.477 0.0 . 229 . 38 LYS HE2 H 2.868 0.0 . 230 . 38 LYS HG2 H 1.031 0.0 . 231 . 38 LYS HG3 H 0.801 0.0 . 232 . 39 PRO HA H 3.973 0.0 . 233 . 39 PRO HB2 H 1.256 0.0 . 234 . 39 PRO HB3 H 1.196 0.0 . 235 . 39 PRO HD2 H 2.594 0.0 . 236 . 39 PRO HD3 H 2.314 0.0 . 237 . 39 PRO HG2 H 0.702 0.0 . 238 . 39 PRO HG3 H 0.379 0.0 . 239 . 40 ASP H H 8.199 0.0 . 240 . 40 ASP N N 120.257 0.0 . 241 . 40 ASP HA H 4.508 0.0 . 242 . 40 ASP HB2 H 2.701 0.0 . 243 . 40 ASP HB3 H 2.583 0.0 . 244 . 41 ASP H H 7.853 0.0 . 245 . 41 ASP N N 123.211 0.0 . 246 . 41 ASP HA H 4.406 0.0 . stop_ save_ save_chemical_shift_set_2 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_1 $sample_2 stop_ _Sample_conditions_label $sample_cond_1 _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'Formin-binding protein 3' _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 . 1 GLY CA C 43.241 0.0 . 2 . 1 GLY HA2 H 3.886 0.0 . 3 . 2 SER CA C 58.302 0.0 . 4 . 2 SER CB C 64.000 0.0 . 5 . 2 SER HA H 4.511 0.0 . 6 . 2 SER HB2 H 3.864 0.0 . 7 . 3 ARG CA C 56.418 0.0 . 8 . 3 ARG CB C 30.831 0.0 . 9 . 3 ARG CD C 43.381 0.0 . 10 . 3 ARG CG C 27.149 0.0 . 11 . 3 ARG HA H 4.318 0.0 . 12 . 3 ARG HB2 H 1.841 0.0 . 13 . 3 ARG HB3 H 1.773 0.0 . 14 . 3 ARG HD2 H 3.194 0.0 . 15 . 3 ARG HG2 H 1.634 0.0 . 16 . 4 ARG CA C 56.112 0.0 . 17 . 4 ARG CB C 30.730 0.0 . 18 . 4 ARG CD C 43.381 0.0 . 19 . 4 ARG CG C 27.149 0.0 . 20 . 4 ARG HA H 4.331 0.0 . 21 . 4 ARG HB2 H 1.826 0.0 . 22 . 4 ARG HB3 H 1.749 0.0 . 23 . 4 ARG HD2 H 3.194 0.0 . 24 . 4 ARG HG2 H 1.634 0.0 . 25 . 5 ALA CA C 52.694 0.0 . 26 . 5 ALA CB C 19.230 0.0 . 27 . 5 ALA HA H 4.305 0.0 . 28 . 5 ALA HB H 1.378 0.0 . 29 . 6 SER CA C 58.258 0.0 . 30 . 6 SER CB C 63.884 0.0 . 31 . 6 SER HA H 4.467 0.0 . 32 . 6 SER HB2 H 3.875 0.0 . 33 . 7 VAL CA C 62.655 0.0 . 34 . 7 VAL CB C 32.679 0.0 . 35 . 7 VAL CG1 C 20.799 0.0 . 36 . 7 VAL CG2 C 20.420 0.0 . 37 . 7 VAL HA H 4.156 0.0 . 38 . 7 VAL HB H 2.100 0.0 . 39 . 7 VAL HG1 H 0.942 0.0 . 40 . 8 GLY CA C 45.270 0.0 . 41 . 8 GLY HA2 H 3.972 0.0 . 42 . 9 SER CA C 58.359 0.0 . 43 . 9 SER CB C 63.824 0.0 . 44 . 9 SER HA H 4.483 0.0 . 45 . 9 SER HB2 H 3.860 0.0 . 46 . 10 ALA CA C 52.694 0.0 . 47 . 10 ALA CB C 19.230 0.0 . 48 . 10 ALA HA H 4.305 0.0 . 49 . 10 ALA HB H 1.378 0.0 . 50 . 11 LYS CA C 56.719 0.0 . 51 . 11 LYS CB C 32.966 0.0 . 52 . 11 LYS CD C 29.150 0.0 . 53 . 11 LYS CG C 24.792 0.0 . 54 . 11 LYS HA H 4.316 0.0 . 55 . 11 LYS HB2 H 1.853 0.0 . 56 . 11 LYS HB3 H 1.774 0.0 . 57 . 11 LYS HD2 H 1.673 0.0 . 58 . 11 LYS HE2 H 2.989 0.0 . 59 . 11 LYS HG2 H 1.432 0.0 . 60 . 12 SER CA C 58.171 0.0 . 61 . 12 SER CB C 63.976 0.0 . 62 . 12 SER HA H 4.507 0.0 . 63 . 12 SER HB2 H 4.020 0.0 . 64 . 12 SER HB3 H 3.875 0.0 . 65 . 13 MET CA C 55.740 0.0 . 66 . 13 MET CB C 32.172 0.0 . 67 . 13 MET CG C 32.190 0.0 . 68 . 13 MET CE C 17.340 0.0 . 69 . 13 MET HA H 4.503 0.0 . 70 . 13 MET HB2 H 2.017 0.0 . 71 . 13 MET HB3 H 1.826 0.0 . 72 . 13 MET HG2 H 2.504 0.0 . 73 . 13 MET HG3 H 2.351 0.0 . 74 . 13 MET HE H 1.998 0.0 . 75 . 14 TRP CA C 56.648 0.0 . 76 . 14 TRP CB C 31.111 0.0 . 77 . 14 TRP CD1 C 128.477 0.0 . 78 . 14 TRP CE3 C 120.530 0.0 . 79 . 14 TRP CH2 C 124.700 0.0 . 80 . 14 TRP CZ2 C 114.688 0.0 . 81 . 14 TRP CZ3 C 123.228 0.0 . 82 . 14 TRP HA H 5.182 0.0 . 83 . 14 TRP HB2 H 3.147 0.0 . 84 . 14 TRP HB3 H 3.046 0.0 . 85 . 14 TRP HD1 H 7.318 0.0 . 86 . 14 TRP HE3 H 7.330 0.0 . 87 . 14 TRP HH2 H 7.024 0.0 . 88 . 14 TRP HZ2 H 7.479 0.0 . 89 . 14 TRP HZ3 H 6.951 0.0 . 90 . 15 THR CA C 59.900 0.0 . 91 . 15 THR CB C 72.004 0.0 . 92 . 15 THR CG2 C 22.225 0.0 . 93 . 15 THR HA H 4.792 0.0 . 94 . 15 THR HB H 4.189 0.0 . 95 . 15 THR HG2 H 1.263 0.0 . 96 . 16 GLU CA C 55.755 0.0 . 97 . 16 GLU CB C 30.877 0.0 . 98 . 16 GLU CG C 35.496 0.0 . 99 . 16 GLU HA H 4.483 0.0 . 100 . 16 GLU HB2 H 1.800 0.0 . 101 . 16 GLU HG2 H 1.970 0.0 . 102 . 17 HIS CA C 53.630 0.0 . 103 . 17 HIS CB C 32.500 0.0 . 104 . 17 HIS CD2 C 118.969 0.0 . 105 . 17 HIS CE1 C 136.664 0.0 . 106 . 17 HIS HA H 4.516 0.0 . 107 . 17 HIS HB2 H 2.588 0.0 . 108 . 17 HIS HB3 H 1.264 0.0 . 109 . 17 HIS HD2 H 6.699 0.0 . 110 . 17 HIS HE1 H 8.381 0.0 . 111 . 18 LYS CA C 54.632 0.0 . 112 . 18 LYS CB C 34.857 0.0 . 113 . 18 LYS CD C 29.112 0.0 . 114 . 18 LYS CE C 41.841 0.0 . 115 . 18 LYS CG C 24.663 0.0 . 116 . 18 LYS HA H 5.169 0.0 . 117 . 18 LYS HB2 H 1.629 0.0 . 118 . 18 LYS HD2 H 1.528 0.0 . 119 . 18 LYS HE2 H 2.870 0.0 . 120 . 18 LYS HG2 H 1.335 0.0 . 121 . 19 SER CA C 56.996 0.0 . 122 . 19 SER CB C 63.209 0.0 . 123 . 19 SER HB2 H 4.433 0.0 . 124 . 19 SER HB3 H 4.156 0.0 . 125 . 20 PRO CA C 65.676 0.0 . 126 . 20 PRO CB C 31.593 0.0 . 127 . 20 PRO CD C 50.797 0.0 . 128 . 20 PRO CG C 27.961 0.0 . 129 . 20 PRO HA H 4.308 0.0 . 130 . 20 PRO HB2 H 2.337 0.0 . 131 . 20 PRO HB3 H 1.736 0.0 . 132 . 20 PRO HD2 H 3.636 0.0 . 133 . 20 PRO HD3 H 3.558 0.0 . 134 . 20 PRO HG2 H 1.864 0.0 . 135 . 21 ASP CA C 53.293 0.0 . 136 . 21 ASP CB C 40.104 0.0 . 137 . 21 ASP HA H 4.615 0.0 . 138 . 21 ASP HB2 H 2.935 0.0 . 139 . 21 ASP HB3 H 2.707 0.0 . 140 . 22 GLY CA C 45.407 0.0 . 141 . 22 GLY HA2 H 4.315 0.0 . 142 . 22 GLY HA3 H 3.618 0.0 . 143 . 23 ARG CA C 56.476 0.0 . 144 . 23 ARG CB C 32.127 0.0 . 145 . 23 ARG CD C 43.553 0.0 . 146 . 23 ARG CG C 27.207 0.0 . 147 . 23 ARG HA H 4.498 0.0 . 148 . 23 ARG HB2 H 2.023 0.0 . 149 . 23 ARG HD2 H 2.766 0.0 . 150 . 23 ARG HG2 H 1.634 0.0 . 151 . 23 ARG HG3 H 1.590 0.0 . 152 . 24 THR CA C 63.192 0.0 . 153 . 24 THR CB C 70.256 0.0 . 154 . 24 THR CG2 C 21.939 0.0 . 155 . 24 THR HA H 4.890 0.0 . 156 . 24 THR HB H 3.961 0.0 . 157 . 24 THR HG2 H 0.871 0.0 . 158 . 25 TYR CA C 55.432 0.0 . 159 . 25 TYR CB C 39.871 0.0 . 160 . 25 TYR CD1 C 133.494 0.0 . 161 . 25 TYR CE1 C 117.412 0.0 . 162 . 25 TYR HA H 4.825 0.0 . 163 . 25 TYR HB2 H 2.389 0.0 . 164 . 25 TYR HD1 H 6.744 0.0 . 165 . 25 TYR HE1 H 6.371 0.0 . 166 . 26 TYR CA C 56.627 0.0 . 167 . 26 TYR CB C 41.053 0.0 . 168 . 26 TYR CD1 C 133.619 0.0 . 169 . 26 TYR CE1 C 117.548 0.0 . 170 . 26 TYR HA H 5.297 0.0 . 171 . 26 TYR HB2 H 2.843 0.0 . 172 . 26 TYR HB3 H 2.676 0.0 . 173 . 26 TYR HD1 H 6.783 0.0 . 174 . 26 TYR HE1 H 6.665 0.0 . 175 . 27 TYR CA C 56.153 0.0 . 176 . 27 TYR CB C 42.868 0.0 . 177 . 27 TYR CD1 C 133.322 0.0 . 178 . 27 TYR CE1 C 117.705 0.0 . 179 . 27 TYR HA H 5.588 0.0 . 180 . 27 TYR HB2 H 2.672 0.0 . 181 . 27 TYR HD1 H 6.930 0.0 . 182 . 27 TYR HE1 H 6.584 0.0 . 183 . 28 ASN CA C 51.545 0.0 . 184 . 28 ASN CB C 38.132 0.0 . 185 . 28 ASN HA H 4.398 0.0 . 186 . 28 ASN HB2 H 2.254 0.0 . 187 . 28 ASN HB3 H 0.049 0.0 . 188 . 29 THR CA C 64.325 0.0 . 189 . 29 THR CB C 68.856 0.0 . 190 . 29 THR CG2 C 22.283 0.0 . 191 . 29 THR HA H 3.708 0.0 . 192 . 29 THR HB H 4.275 0.0 . 193 . 29 THR HG2 H 1.379 0.0 . 194 . 30 GLU CA C 57.893 0.0 . 195 . 30 GLU CB C 29.632 0.0 . 196 . 30 GLU CG C 35.051 0.0 . 197 . 30 GLU HA H 4.261 0.0 . 198 . 30 GLU HB2 H 2.052 0.0 . 199 . 30 GLU HG2 H 2.246 0.0 . 200 . 30 GLU HG3 H 2.132 0.0 . 201 . 31 THR CA C 61.709 0.0 . 202 . 31 THR CB C 69.862 0.0 . 203 . 31 THR CG2 C 21.033 0.0 . 204 . 31 THR HA H 4.097 0.0 . 205 . 31 THR HB H 4.220 0.0 . 206 . 31 THR HG2 H 0.946 0.0 . 207 . 32 LYS CA C 57.358 0.0 . 208 . 32 LYS CB C 28.769 0.0 . 209 . 32 LYS CE C 42.350 0.0 . 210 . 32 LYS CG C 25.183 0.0 . 211 . 32 LYS HA H 3.614 0.0 . 212 . 32 LYS HB2 H 2.118 0.0 . 213 . 32 LYS HB3 H 2.039 0.0 . 214 . 32 LYS HD2 H 1.608 0.0 . 215 . 32 LYS HE2 H 2.984 0.0 . 216 . 32 LYS HG2 H 1.192 0.0 . 217 . 33 GLN CA C 54.834 0.0 . 218 . 33 GLN CB C 31.116 0.0 . 219 . 33 GLN CG C 33.804 0.0 . 220 . 33 GLN HA H 4.402 0.0 . 221 . 33 GLN HB2 H 2.070 0.0 . 222 . 33 GLN HB3 H 1.705 0.0 . 223 . 33 GLN HG2 H 2.348 0.0 . 224 . 34 SER CA C 57.031 0.0 . 225 . 34 SER CB C 66.158 0.0 . 226 . 34 SER HA H 6.055 0.0 . 227 . 34 SER HB2 H 3.660 0.0 . 228 . 34 SER HB3 H 3.660 0.0 . 229 . 35 THR CA C 59.664 0.0 . 230 . 35 THR CB C 69.862 0.0 . 231 . 35 THR CG2 C 20.335 0.0 . 232 . 35 THR HA H 4.767 0.0 . 233 . 35 THR HB H 4.220 0.0 . 234 . 35 THR HG2 H 1.089 0.0 . 235 . 36 TRP CA C 58.205 0.0 . 236 . 36 TRP CB C 30.346 0.0 . 237 . 36 TRP CD1 C 127.957 0.0 . 238 . 36 TRP CE3 C 121.722 0.0 . 239 . 36 TRP CH2 C 124.290 0.0 . 240 . 36 TRP CZ2 C 114.440 0.0 . 241 . 36 TRP CZ3 C 123.228 0.0 . 242 . 36 TRP HA H 5.034 0.0 . 243 . 36 TRP HB2 H 3.661 0.0 . 244 . 36 TRP HB3 H 3.169 0.0 . 245 . 36 TRP HD1 H 7.356 0.0 . 246 . 36 TRP HE3 H 8.007 0.0 . 247 . 36 TRP HH2 H 7.101 0.0 . 248 . 36 TRP HZ2 H 7.314 0.0 . 249 . 36 TRP HZ3 H 6.951 0.0 . 250 . 37 GLU CA C 54.715 0.0 . 251 . 37 GLU CB C 30.244 0.0 . 252 . 37 GLU CG C 34.405 0.0 . 253 . 37 GLU HA H 4.483 0.0 . 254 . 37 GLU HB2 H 1.887 0.0 . 255 . 37 GLU HB3 H 1.781 0.0 . 256 . 37 GLU HG2 H 2.280 0.0 . 257 . 38 LYS CA C 54.525 0.0 . 258 . 38 LYS CB C 32.415 0.0 . 259 . 38 LYS CD C 29.362 0.0 . 260 . 38 LYS CG C 23.986 0.0 . 261 . 38 LYS HA H 2.979 0.0 . 262 . 38 LYS HB2 H 1.390 0.0 . 263 . 38 LYS HB3 H 1.279 0.0 . 264 . 38 LYS HD2 H 1.494 0.0 . 265 . 38 LYS HE2 H 2.868 0.0 . 266 . 38 LYS HG2 H 1.023 0.0 . 267 . 38 LYS HG3 H 0.787 0.0 . 268 . 39 PRO CA C 62.576 0.0 . 269 . 39 PRO CB C 31.747 0.0 . 270 . 39 PRO CD C 50.375 0.0 . 271 . 39 PRO CG C 25.874 0.0 . 272 . 39 PRO HA H 3.955 0.0 . 273 . 39 PRO HB2 H 1.278 0.0 . 274 . 39 PRO HB3 H 1.191 0.0 . 275 . 39 PRO HD2 H 2.556 0.0 . 276 . 39 PRO HD3 H 2.278 0.0 . 277 . 39 PRO HG2 H 0.653 0.0 . 278 . 39 PRO HG3 H 0.325 0.0 . 279 . 40 ASP CA C 53.379 0.0 . 280 . 40 ASP CB C 40.365 0.0 . 281 . 40 ASP HA H 4.513 0.0 . 282 . 40 ASP HB2 H 2.692 0.0 . 283 . 40 ASP HB3 H 2.539 0.0 . 284 . 41 ASP CA C 54.357 0.0 . 285 . 41 ASP CB C 40.775 0.0 . 286 . 41 ASP HA H 4.406 0.0 . stop_ save_