data_15188 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; backbone and side chain methly order parameters and correlation times for calcium-saturated calmodulin ; _BMRB_accession_number 15188 _BMRB_flat_file_name bmr15188.str _Entry_type original _Submission_date 2007-03-19 _Accession_date 2007-03-19 _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 Frederick Kendra K. . 2 Marlow Michael S. . 3 Valentine Kathleen G. . 4 Wand Joshua . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count S2_parameters 2 stop_ loop_ _Data_type _Data_type_count "order parameters" 134 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2011-03-28 update BMRB ; Inserted tags and values for Tau e, f, and s units corrected atom nomenclature in the side chain methyl order parameter save frame ; 2009-01-29 update BMRB 'correction of residue codes' 2007-10-05 original author 'original release' stop_ loop_ _Related_BMRB_accession_number _Relationship 15183 CaM/CaMKKap 15184 CaM/CaMK1p 15185 Cam/eNOSp 15186 Cam/smMLCKp 15187 CaM/PDEs 6541 'Ca-bound calmodulin' stop_ save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'Conformational entropy in molecular recognition by proteins' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 17637663 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Frederick Kendra K. . 2 Marlow Michael S. . 3 Valentine Kathleen G. . 4 Wand Joshua . . stop_ _Journal_abbreviation Nature _Journal_volume 448 _Journal_issue 7151 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 325 _Page_last 329 _Year 2007 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name calmodulin _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label calmodulin $calmodulin stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_calmodulin _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common calmodulin _Molecular_mass . _Mol_thiol_state 'not present' loop_ _Biological_function 'Ca2+-binding protein' stop_ _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 148 _Mol_residue_sequence ; ADQLTEEQIAEFKEAFSLFD KDGDGTITTKELGTVMRSLG QNPTEAELQDMINEVDADGN GTIDFPEFLTMMARKMKDTD SEEEIREAFRVFDKDGNGYI SAAELRHVMTNLGEKLTDEQ VDEMIREADIDGDGQVNYEE FVQMMTAK ; loop_ _Residue_seq_code _Residue_label 1 ALA 2 ASP 3 GLN 4 LEU 5 THR 6 GLU 7 GLU 8 GLN 9 ILE 10 ALA 11 GLU 12 PHE 13 LYS 14 GLU 15 ALA 16 PHE 17 SER 18 LEU 19 PHE 20 ASP 21 LYS 22 ASP 23 GLY 24 ASP 25 GLY 26 THR 27 ILE 28 THR 29 THR 30 LYS 31 GLU 32 LEU 33 GLY 34 THR 35 VAL 36 MET 37 ARG 38 SER 39 LEU 40 GLY 41 GLN 42 ASN 43 PRO 44 THR 45 GLU 46 ALA 47 GLU 48 LEU 49 GLN 50 ASP 51 MET 52 ILE 53 ASN 54 GLU 55 VAL 56 ASP 57 ALA 58 ASP 59 GLY 60 ASN 61 GLY 62 THR 63 ILE 64 ASP 65 PHE 66 PRO 67 GLU 68 PHE 69 LEU 70 THR 71 MET 72 MET 73 ALA 74 ARG 75 LYS 76 MET 77 LYS 78 ASP 79 THR 80 ASP 81 SER 82 GLU 83 GLU 84 GLU 85 ILE 86 ARG 87 GLU 88 ALA 89 PHE 90 ARG 91 VAL 92 PHE 93 ASP 94 LYS 95 ASP 96 GLY 97 ASN 98 GLY 99 TYR 100 ILE 101 SER 102 ALA 103 ALA 104 GLU 105 LEU 106 ARG 107 HIS 108 VAL 109 MET 110 THR 111 ASN 112 LEU 113 GLY 114 GLU 115 LYS 116 LEU 117 THR 118 ASP 119 GLU 120 GLN 121 VAL 122 ASP 123 GLU 124 MET 125 ILE 126 ARG 127 GLU 128 ALA 129 ASP 130 ILE 131 ASP 132 GLY 133 ASP 134 GLY 135 GLN 136 VAL 137 ASN 138 TYR 139 GLU 140 GLU 141 PHE 142 VAL 143 GLN 144 MET 145 MET 146 THR 147 ALA 148 LYS stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-10-07 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 15184 calmodulin 100.00 148 99.32 100.00 9.29e-100 BMRB 15185 calmodulin 100.00 148 99.32 100.00 9.29e-100 BMRB 15186 calmodulin 100.00 148 99.32 100.00 9.29e-100 BMRB 15187 calmodulin 100.00 148 99.32 100.00 9.29e-100 BMRB 15191 Calmodulin 100.00 148 99.32 100.00 9.29e-100 BMRB 15470 calmodulin 100.00 148 98.65 100.00 4.63e-99 BMRB 15624 Calmodulin 100.00 148 99.32 100.00 9.29e-100 BMRB 15650 calmodulin 100.00 148 98.65 100.00 7.32e-99 BMRB 15852 calmodulin 100.00 148 98.65 100.00 7.32e-99 BMRB 16418 apoCaM 100.00 148 99.32 100.00 9.29e-100 BMRB 16465 entity_1 100.00 148 99.32 100.00 9.29e-100 BMRB 16764 CALMODULIN 100.00 150 99.32 100.00 9.93e-100 BMRB 17264 calmodulin 100.00 148 99.32 100.00 9.29e-100 BMRB 17360 entity_1 100.00 148 99.32 100.00 9.29e-100 BMRB 17771 Calmodulin 100.00 148 99.32 100.00 9.29e-100 BMRB 17807 Calmodulin 99.32 147 99.32 100.00 5.82e-99 BMRB 18027 CaM 100.00 148 99.32 100.00 9.29e-100 BMRB 18028 CaM 100.00 148 99.32 100.00 9.29e-100 BMRB 18556 Calmodulin 100.00 148 97.97 99.32 5.12e-98 BMRB 19036 calmodulin 100.00 148 99.32 100.00 9.29e-100 BMRB 19238 Calmodulin_prototypical_calcium_sensor 100.00 148 99.32 100.00 9.29e-100 BMRB 19586 entity_1 100.00 148 99.32 100.00 9.29e-100 BMRB 19604 calmodulin 100.00 148 99.32 100.00 9.29e-100 BMRB 25253 CaM 100.00 148 97.97 99.32 2.66e-97 BMRB 25257 CaM 100.00 148 97.97 99.32 2.66e-97 BMRB 26503 Calmodulin 100.00 148 99.32 100.00 9.29e-100 BMRB 26626 CaM 100.00 148 99.32 100.00 9.29e-100 BMRB 26627 CaM 100.00 148 99.32 100.00 9.29e-100 BMRB 4056 calmodulin 100.00 148 99.32 100.00 9.29e-100 BMRB 4270 calmodulin 100.00 148 99.32 100.00 9.29e-100 BMRB 4284 Calmodulin 100.00 148 99.32 100.00 9.29e-100 BMRB 4310 calmodulin 100.00 148 99.32 100.00 9.29e-100 PDB 1A29 "Calmodulin Complexed With Trifluoperazine (1:2 Complex)" 100.00 148 99.32 100.00 9.29e-100 PDB 1CFC "Calcium-Free Calmodulin" 100.00 148 99.32 100.00 9.29e-100 PDB 1CFD "Calcium-Free Calmodulin" 100.00 148 99.32 100.00 9.29e-100 PDB 1CFF "Nmr Solution Structure Of A Complex Of Calmodulin With A Binding Peptide Of The Ca2+-Pump" 100.00 148 99.32 100.00 9.29e-100 PDB 1CKK "CalmodulinRAT CA2+CALMODULIN DEPENDENT PROTEIN KINASE Fragment" 100.00 148 99.32 100.00 9.29e-100 PDB 1CLL "Calmodulin Structure Refined At 1.7 Angstroms Resolution" 100.00 148 99.32 100.00 9.29e-100 PDB 1CM1 "Motions Of Calmodulin-Single-Conformer Refinement" 100.00 148 99.32 100.00 9.29e-100 PDB 1CM4 "Motions Of Calmodulin-four-conformer Refinement" 100.00 148 99.32 100.00 9.29e-100 PDB 1CTR "Drug Binding By Calmodulin: Crystal Structure Of A Calmodulin-Trifluoperazine Complex" 100.00 148 99.32 100.00 9.29e-100 PDB 1DMO "Calmodulin, Nmr, 30 Structures" 100.00 148 98.65 100.00 4.63e-99 PDB 1G4Y "1.60 A Crystal Structure Of The Gating Domain From Small Conductance Potassium Channel Complexed With Calcium-Calmodulin" 100.00 148 99.32 100.00 9.29e-100 PDB 1IQ5 "CalmodulinNEMATODE CA2+CALMODULIN DEPENDENT KINASE KINASE Fragment" 100.00 149 99.32 100.00 1.17e-99 PDB 1IWQ "Crystal Structure Of Marcks Calmodulin Binding Domain Peptide Complexed With Ca2+CALMODULIN" 100.00 148 99.32 100.00 9.29e-100 PDB 1K90 "Crystal Structure Of The Adenylyl Cyclase Domain Of Anthrax Edema Factor (Ef) In Complex With Calmodulin And 3' Deoxy-Atp" 100.00 148 99.32 100.00 9.29e-100 PDB 1K93 "Crystal Structure Of The Adenylyl Cyclase Domain Of Anthrax Edema Factor (Ef) In Complex With Calmodulin" 97.30 144 99.31 100.00 1.09e-96 PDB 1L7Z "Crystal Structure Of Ca2+/calmodulin Complexed With Myristoylated Cap-23/nap-22 Peptide" 100.00 148 99.32 100.00 9.29e-100 PDB 1LIN "Calmodulin Complexed With Trifluoperazine (1:4 Complex)" 100.00 148 99.32 100.00 9.29e-100 PDB 1LVC "Crystal Structure Of The Adenylyl Cyclase Domain Of Anthrax Edema Factor (Ef) In Complex With Calmodulin And 2' Deoxy, 3' Anthr" 100.00 149 99.32 100.00 1.17e-99 PDB 1MUX "Solution Nmr Structure Of CalmodulinW-7 Complex: The Basis Of Diversity In Molecular Recognition, 30 Structures" 100.00 148 99.32 100.00 9.29e-100 PDB 1MXE "Structure Of The Complex Of Calmodulin With The Target Sequence Of Camki" 100.00 148 97.30 99.32 1.20e-97 PDB 1NWD "Solution Structure Of Ca2+CALMODULIN BOUND TO THE C- Terminal Domain Of Petunia Glutamate Decarboxylase" 100.00 148 99.32 100.00 9.29e-100 PDB 1OOJ "Structural Genomics Of Caenorhabditis Elegans : Calmodulin" 100.00 149 97.30 98.65 3.46e-97 PDB 1PRW "Crystal Structure Of Bovine Brain Ca++ Calmodulin In A Compact Form" 100.00 149 98.65 99.32 9.63e-99 PDB 1QIV "Calmodulin Complexed With N-(3,3,-Diphenylpropyl)-N'-[1-R-( 3,4-Bis-Butoxyphenyl)-Ethyl]-Propylenediamine (Dpd), 1:2 Complex" 100.00 148 99.32 100.00 9.29e-100 PDB 1QIW "Calmodulin Complexed With N-(3,3,-Diphenylpropyl)-N'-[1-R-( 3,4-Bis-Butoxyphenyl)-Ethyl]-Propylenediamine (Dpd)" 100.00 148 99.32 100.00 9.29e-100 PDB 1QX5 "Crystal Structure Of Apocalmodulin" 100.00 148 99.32 100.00 9.29e-100 PDB 1S26 "Structure Of Anthrax Edema Factor-calmodulin-alpha,beta- Methyleneadenosine 5'-triphosphate Complex Reveals An Alternative Mode" 100.00 148 99.32 100.00 9.29e-100 PDB 1SK6 "Crystal Structure Of The Adenylyl Cyclase Domain Of Anthrax Edema Factor (Ef) In Complex With Calmodulin, 3',5' Cyclic Amp (Cam" 100.00 148 99.32 100.00 9.29e-100 PDB 1SY9 "Structure Of Calmodulin Complexed With A Fragment Of The Olfactory Cng Channel" 100.00 148 99.32 100.00 9.29e-100 PDB 1UP5 "Chicken Calmodulin" 100.00 148 98.65 99.32 9.31e-99 PDB 1WRZ "Calmodulin Complexed With A Peptide From A Human Death-Associated Protein Kinase" 100.00 149 99.32 100.00 1.17e-99 PDB 1X02 "Solution Structure Of Stereo Array Isotope Labeled (Sail) Calmodulin" 100.00 148 99.32 100.00 9.29e-100 PDB 1XA5 "Structure Of Calmodulin In Complex With Kar-2, A Bis-Indol Alkaloid" 100.00 148 99.32 100.00 9.29e-100 PDB 1XFU "Crystal Structure Of Anthrax Edema Factor (ef) Truncation Mutant, Ef-delta 64 In Complex With Calmodulin" 100.00 149 98.65 100.00 3.34e-99 PDB 1XFV "Crystal Structure Of Anthrax Edema Factor (Ef) In Complex With Calmodulin And 3' Deoxy-Atp" 100.00 149 98.65 100.00 3.34e-99 PDB 1XFW "Crystal Structure Of Anthrax Edema Factor (Ef) In Complex With Calmodulin And 3'5' Cyclic Amp (Camp)" 100.00 149 98.65 100.00 3.34e-99 PDB 1XFY "Crystal Structure Of Anthrax Edema Factor (Ef) In Complex With Calmodulin" 100.00 149 98.65 100.00 3.34e-99 PDB 1XFZ "Crystal Structure Of Anthrax Edema Factor (ef) In Complex With Calmodulin In The Presence Of 1 Millimolar Exogenously Added Cal" 100.00 149 98.65 100.00 3.34e-99 PDB 1Y0V "Crystal Structure Of Anthrax Edema Factor (Ef) In Complex With Calmodulin And Pyrophosphate" 97.30 146 99.31 100.00 9.04e-97 PDB 1YR5 "1.7-A Structure Of Calmodulin Bound To A Peptide From Dap Kinase" 100.00 148 99.32 100.00 9.29e-100 PDB 2BBM "Solution Structure Of A Calmodulin-Target Peptide Complex By Multidimensional Nmr" 100.00 148 97.30 99.32 1.20e-97 PDB 2BBN "Solution Structure Of A Calmodulin-Target Peptide Complex By Multidimensional Nmr" 100.00 148 97.30 99.32 1.20e-97 PDB 2BCX "Crystal Structure Of Calmodulin In Complex With A Ryanodine Receptor Peptide" 100.00 148 99.32 100.00 9.29e-100 PDB 2BKH "Myosin Vi Nucleotide-Free (Mdinsert2) Crystal Structure" 100.00 149 97.30 99.32 1.32e-97 PDB 2BKI "Myosin Vi Nucleotide-free (mdinsert2-iq) Crystal Structure" 100.00 149 99.32 100.00 1.17e-99 PDB 2DFS "3-D Structure Of Myosin-V Inhibited State" 100.00 148 99.32 100.00 9.29e-100 PDB 2F2O "Structure Of Calmodulin Bound To A Calcineurin Peptide: A New Way Of Making An Old Binding Mode" 100.00 179 99.32 100.00 2.01e-99 PDB 2F2P "Structure Of Calmodulin Bound To A Calcineurin Peptide: A New Way Of Making An Old Binding Mode" 100.00 179 99.32 100.00 2.01e-99 PDB 2F3Y "CalmodulinIQ DOMAIN COMPLEX" 100.00 148 99.32 100.00 9.29e-100 PDB 2F3Z "CalmodulinIQ-Aa Domain Complex" 100.00 148 99.32 100.00 9.29e-100 PDB 2FOT "Crystal Structure Of The Complex Between Calmodulin And Alphaii-Spectrin" 100.00 148 99.32 100.00 9.29e-100 PDB 2HQW "Crystal Structure Of Ca2+CALMODULIN BOUND TO NMDA RECEPTOR NR1C1 Peptide" 100.00 148 99.32 100.00 9.29e-100 PDB 2JZI "Structure Of Calmodulin Complexed With The Calmodulin Binding Domain Of Calcineurin" 100.00 148 99.32 100.00 9.29e-100 PDB 2K0E "A Coupled Equilibrium Shift Mechanism In Calmodulin- Mediated Signal Transduction" 100.00 148 99.32 100.00 9.29e-100 PDB 2K0F "Calmodulin Complexed With Calmodulin-Binding Peptide From Smooth Muscle Myosin Light Chain Kinase" 100.00 148 99.32 100.00 9.29e-100 PDB 2K0J "Solution Structure Of Cam Complexed To Drp1p" 100.00 148 98.65 100.00 7.32e-99 PDB 2K61 "Solution Structure Of Cam Complexed To Dapk Peptide" 100.00 148 98.65 100.00 7.32e-99 PDB 2KDU "Structural Basis Of The Munc13-1CA2+-Calmodulin Interaction: A Novel 1-26 Calmodulin Binding Motif With A Bipartite Binding Mod" 100.00 148 99.32 100.00 9.29e-100 PDB 2KNE "Calmodulin Wraps Around Its Binding Domain In The Plasma Membrane Ca2+ Pump Anchored By A Novel 18-1 Motif" 100.00 148 99.32 100.00 9.29e-100 PDB 2L53 "Solution Nmr Structure Of Apo-Calmodulin In Complex With The Iq Motif Of Human Cardiac Sodium Channel Nav1.5" 100.00 148 99.32 100.00 9.29e-100 PDB 2L7L "Solution Structure Of Ca2+CALMODULIN COMPLEXED WITH A PEPTIDE Representing The Calmodulin-Binding Domain Of Calmodulin Kinase I" 100.00 148 99.32 100.00 9.29e-100 PDB 2LGF "Solution Structure Of Ca2+CALMODULIN COMPLEXED WITH A PEPTIDE Representing The Calmodulin-Binding Domain Of L-Selectin" 98.65 146 99.32 100.00 2.43e-98 PDB 2LL6 "Solution Nmr Structure Of Cam Bound To Inos Cam Binding Domain Peptide" 100.00 148 99.32 100.00 9.29e-100 PDB 2LL7 "Solution Nmr Structure Of Cam Bound To The Enos Cam Binding Domain Peptide" 100.00 148 99.32 100.00 9.29e-100 PDB 2LV6 "The Complex Between Ca-calmodulin And Skeletal Muscle Myosin Light Chain Kinase From Combination Of Nmr And Aqueous And Contras" 100.00 148 97.97 99.32 5.12e-98 PDB 2M0J "3d Structure Of Calmodulin And Calmodulin Binding Domain Of Olfactory Cyclic Nucleotide-gated Ion Channel Complex" 100.00 148 99.32 100.00 9.29e-100 PDB 2M0K "3d Structure Of Calmodulin And Calmodulin Binding Domain Of Rat Olfactory Cyclic Nucleotide-gated Ion Channel" 100.00 148 99.32 100.00 9.29e-100 PDB 2M55 "Nmr Structure Of The Complex Of An N-terminally Acetylated Alpha- Synuclein Peptide With Calmodulin" 100.00 148 99.32 100.00 9.29e-100 PDB 2MG5 "Solution Structure Of Calmodulin Bound To The Target Peptide Of Endothelial Nitrogen Oxide Synthase Phosphorylated At Thr495" 100.00 148 99.32 100.00 9.29e-100 PDB 2MGU "Structure Of The Complex Between Calmodulin And The Binding Domain Of Hiv-1 Matrix Protein" 100.00 148 99.32 100.00 9.29e-100 PDB 2O5G "Calmodulin-Smooth Muscle Light Chain Kinase Peptide Complex" 100.00 148 99.32 100.00 9.29e-100 PDB 2O60 "Calmodulin Bound To Peptide From Neuronal Nitric Oxide Synthase" 100.00 148 99.32 100.00 9.29e-100 PDB 2R28 "The Complex Structure Of Calmodulin Bound To A Calcineurin Peptide" 100.00 149 99.32 100.00 1.17e-99 PDB 2V01 "Recombinant Vertebrate Calmodulin Complexed With Pb" 100.00 149 99.32 100.00 1.17e-99 PDB 2V02 "Recombinant Vertebrate Calmodulin Complexed With Ba" 100.00 149 99.32 100.00 1.17e-99 PDB 2VAS "Myosin Vi (Md-Insert2-Cam, Delta-Insert1) Post-Rigor State" 100.00 149 97.30 99.32 1.32e-97 PDB 2VAY "Calmodulin Complexed With Cav1.1 Iq Peptide" 98.65 146 99.32 100.00 2.43e-98 PDB 2W73 "High-Resolution Structure Of The Complex Between Calmodulin And A Peptide From Calcineurin A" 100.00 149 99.32 100.00 1.17e-99 PDB 2WEL "Crystal Structure Of Su6656-Bound CalciumCALMODULIN- Dependent Protein Kinase Ii Delta In Complex With Calmodulin" 100.00 150 99.32 100.00 1.16e-99 PDB 2X0G "X-ray Structure Of A Dap-kinase Calmodulin Complex" 100.00 148 99.32 100.00 9.29e-100 PDB 2X51 "M6 Delta Insert1" 100.00 149 97.30 99.32 1.32e-97 PDB 2Y4V "Crystal Structure Of Human Calmodulin In Complex With A Dap Kinase-1 Mutant (W305y) Peptide" 100.00 149 99.32 100.00 1.17e-99 PDB 2YGG "Complex Of Cambr And Cam" 100.00 150 99.32 100.00 1.25e-99 PDB 3BXK "Crystal Structure Of The PQ-Type Calcium Channel (Cav2.1) Iq Domain And Ca2+calmodulin Complex" 100.00 148 99.32 100.00 9.29e-100 PDB 3BXL "Crystal Structure Of The R-Type Calcium Channel (Cav2.3) Iq Domain And Ca2+calmodulin Complex" 100.00 148 99.32 100.00 9.29e-100 PDB 3BYA "Structure Of A Calmodulin Complex" 100.00 148 99.32 100.00 9.29e-100 PDB 3CLN "Structure Of Calmodulin Refined At 2.2 Angstroms Resolution" 100.00 148 98.65 100.00 4.63e-99 PDB 3DVE "Crystal Structure Of Ca2+CAM-Cav2.2 Iq Domain Complex" 100.00 148 99.32 100.00 9.29e-100 PDB 3DVJ "Crystal Structure Of Ca2+CAM-Cav2.2 Iq Domain (Without Cloning Artifact, Hm To Tv) Complex" 100.00 148 99.32 100.00 9.29e-100 PDB 3DVK "Crystal Structure Of Ca2+CAM-Cav2.3 Iq Domain Complex" 100.00 148 99.32 100.00 9.29e-100 PDB 3DVM "Crystal Structure Of Ca2+CAM-Cav2.1 Iq Domain Complex" 100.00 148 99.32 100.00 9.29e-100 PDB 3EK4 "Calcium-saturated Gcamp2 Monomer" 99.32 449 99.32 100.00 2.26e-95 PDB 3EK7 "Calcium-Saturated Gcamp2 Dimer" 99.32 449 99.32 100.00 2.26e-95 PDB 3EK8 "Calcium-Saturated Gcamp2 T116vG87R MUTANT MONOMER" 99.32 449 99.32 100.00 2.47e-95 PDB 3EKH "Calcium-Saturated Gcamp2 T116vK378W MUTANT MONOMER" 99.32 449 98.64 99.32 2.29e-94 PDB 3EVU "Crystal Structure Of Calcium Bound Dimeric Gcamp2, (#1)" 99.32 449 99.32 100.00 2.26e-95 PDB 3EVV "Crystal Structure Of Calcium Bound Dimeric Gcamp2 (#2)" 99.32 449 99.32 100.00 2.26e-95 PDB 3EWT "Crystal Structure Of Calmodulin Complexed With A Peptide" 100.00 154 99.32 100.00 4.79e-100 PDB 3EWV "Crystal Structure Of Calmodulin Complexed With A Peptide" 100.00 154 99.32 100.00 4.79e-100 PDB 3G43 "Crystal Structure Of The Calmodulin-Bound Cav1.2 C-Terminal Regulatory Domain Dimer" 100.00 148 99.32 100.00 9.29e-100 PDB 3GN4 "Myosin Lever Arm" 100.00 149 97.30 99.32 1.32e-97 PDB 3GOF "Calmodulin Bound To Peptide From Macrophage Nitric Oxide Synthase" 100.00 148 99.32 100.00 9.29e-100 PDB 3HR4 "Human Inos Reductase And Calmodulin Complex" 100.00 149 99.32 100.00 1.17e-99 PDB 3IF7 "Structure Of Calmodulin Complexed With Its First Endogenous Inhibitor, Sphingosylphosphorylcholine" 100.00 148 99.32 100.00 9.29e-100 PDB 3J41 "Pseudo-atomic Model Of The Aquaporin-0/calmodulin Complex Derived From Electron Microscopy" 100.00 149 99.32 100.00 1.17e-99 PDB 3L9I "Myosin Vi Nucleotide-Free (Mdinsert2) L310g Mutant Crystal Structure" 100.00 149 97.30 99.32 1.32e-97 PDB 3O77 "The Structure Of Ca2+ Sensor (Case-16)" 99.32 415 99.32 100.00 1.26e-95 PDB 3O78 "The Structure Of Ca2+ Sensor (Case-12)" 99.32 415 99.32 100.00 1.25e-95 PDB 3OXQ "Crystal Structure Of Ca2+CAM-Cav1.2 Pre-IqIQ DOMAIN COMPLEX" 100.00 149 99.32 100.00 1.17e-99 PDB 3SG2 "Crystal Structure Of Gcamp2-t116v,d381y" 99.32 449 98.64 99.32 4.01e-94 PDB 3SG3 "Crystal Structure Of Gcamp3-d380y" 99.32 449 97.96 99.32 3.23e-93 PDB 3SG4 "Crystal Structure Of Gcamp3-d380y, Lp(linker 2)" 100.00 448 97.30 98.65 2.17e-93 PDB 3SG5 "Crystal Structure Of Dimeric Gcamp3-d380y, Qp(linker 1), Lp(linker 2)" 100.00 448 97.30 98.65 2.50e-93 PDB 3SG6 "Crystal Structure Of Dimeric Gcamp2-lia(linker 1)" 99.32 450 99.32 100.00 2.62e-95 PDB 3SG7 "Crystal Structure Of Gcamp3-kf(linker 1)" 99.32 448 98.64 100.00 2.35e-94 PDB 3SJQ "Crystal Structure Of A Small Conductance Potassium Channel Splice Variant Complexed With Calcium-Calmodulin" 100.00 149 99.32 100.00 1.17e-99 PDB 3SUI "Crystal Structure Of Ca2+-Calmodulin In Complex With A Trpv1 C- Terminal Peptide" 100.00 149 99.32 100.00 1.17e-99 PDB 3U0K "Crystal Structure Of The Genetically Encoded Calcium Indicator Rcamp" 99.32 440 97.96 99.32 6.55e-94 PDB 3WFN "Crystal Structure Of Nav1.6 Iq Motif In Complex With Apo-cam" 100.00 182 99.32 100.00 1.58e-99 PDB 4ANJ "Myosin Vi (Mdinsert2-Gfp Fusion) Pre-Powerstroke State (Mg.Adp.Alf4)" 100.00 149 97.30 99.32 1.32e-97 PDB 4BW7 "Calmodulin In Complex With Strontium" 100.00 149 99.32 100.00 1.17e-99 PDB 4BW8 "Calmodulin With Small Bend In Central Helix" 100.00 149 99.32 100.00 1.17e-99 PDB 4BYF "Crystal Structure Of Human Myosin 1c In Complex With Calmodulin In The Pre-power Stroke State" 100.00 149 99.32 100.00 1.17e-99 PDB 4CLN "Structure Of A Recombinant Calmodulin From Drosophila Melanogaster Refined At 2.2-Angstroms Resolution" 100.00 148 97.30 99.32 1.20e-97 PDB 4DBP "Myosin Vi Nucleotide-free (mdinsert2) D179y Crystal Structure" 100.00 149 97.30 99.32 1.32e-97 PDB 4DBQ "Myosin Vi D179y (md-insert2-cam, Delta-insert1) Post-rigor State" 100.00 149 97.30 99.32 1.32e-97 PDB 4DCK "Crystal Structure Of The C-Terminus Of Voltage-Gated Sodium Channel In Complex With Fgf13 And Cam" 100.00 149 99.32 100.00 1.17e-99 PDB 4DJC "1.35 A Crystal Structure Of The Nav1.5 Diii-Iv-CaCAM COMPLEX" 100.00 152 99.32 100.00 8.26e-100 PDB 4E50 "Calmodulin And Ng Peptide Complex" 100.00 185 99.32 100.00 6.56e-100 PDB 4EHQ "Crystal Structure Of Calmodulin Binding Domain Of Orai1 In Complex With Ca2+CALMODULIN DISPLAYS A UNIQUE BINDING MODE" 100.00 148 99.32 100.00 9.29e-100 PDB 4G27 "Calcium-Calmodulin Complexed With The Calmodulin Binding Domain From A Small Conductance Potassium Channel Splice Variant And P" 100.00 149 99.32 100.00 1.17e-99 PDB 4G28 "Calcium-Calmodulin Complexed With The Calmodulin Binding Domain From A Small Conductance Potassium Channel Splice Variant And E" 100.00 149 99.32 100.00 1.17e-99 PDB 4HEX "A Novel Conformation Of Calmodulin" 100.00 156 99.32 100.00 5.13e-100 PDB 4IK1 "High Resolution Structure Of Gcampj At Ph 8.5" 99.32 448 97.96 99.32 2.94e-93 PDB 4IK3 "High Resolution Structure Of Gcamp3 At Ph 8.5" 99.32 448 98.64 100.00 2.11e-94 PDB 4IK4 "High Resolution Structure Of Gcamp3 At Ph 5.0" 99.32 448 98.64 100.00 2.11e-94 PDB 4IK5 "High Resolution Structure Of Delta-rest-gcamp3" 99.32 414 98.64 100.00 6.94e-95 PDB 4IK8 "High Resolution Structure Of Gcamp3 Dimer Form 1 At Ph 7.5" 99.32 448 98.64 100.00 2.11e-94 PDB 4IK9 "High Resolution Structure Of Gcamp3 Dimer Form 2 At Ph 7.5" 99.32 448 98.64 100.00 2.11e-94 PDB 4J9Y "Calcium-calmodulin Complexed With The Calmodulin Binding Domain From A Small Conductance Potassium Channel Splice Variant" 100.00 149 99.32 100.00 1.17e-99 PDB 4J9Z "Calcium-calmodulin Complexed With The Calmodulin Binding Domain From A Small Conductance Potassium Channel Splice Variant And N" 100.00 149 99.32 100.00 1.17e-99 PDB 4JPZ "Voltage-gated Sodium Channel 1.2 C-terminal Domain In Complex With Fgf13u And Ca2+/calmodulin" 100.00 149 99.32 100.00 1.17e-99 PDB 4JQ0 "Voltage-gated Sodium Channel 1.5 C-terminal Domain In Complex With Fgf12b And Ca2+/calmodulin" 100.00 149 99.32 100.00 1.17e-99 PDB 4L79 "Crystal Structure Of Nucleotide-free Myosin 1b Residues 1-728 With Bound Calmodulin" 100.00 149 99.32 100.00 1.17e-99 PDB 4LZX "Complex Of Iqcg And Ca2+-free Cam" 100.00 148 99.32 100.00 9.29e-100 PDB 4M1L "Complex Of Iqcg And Ca2+-bound Cam" 100.00 148 99.32 100.00 9.29e-100 PDB 4Q5U "Structure Of Calmodulin Bound To Its Recognition Site From Calcineurin" 100.00 149 99.32 100.00 1.17e-99 PDB 4QNH "Calcium-calmodulin (t79d) Complexed With The Calmodulin Binding Domain From A Small Conductance Potassium Channel Sk2-a" 100.00 149 98.65 99.32 1.41e-98 PDB 4R8G "Crystal Structure Of Myosin-1c Tail In Complex With Calmodulin" 100.00 148 99.32 100.00 9.29e-100 PDB 4UMO "Crystal Structure Of The Kv7.1 Proximal C-terminal Domain In Complex With Calmodulin" 100.00 149 99.32 100.00 1.17e-99 PDB 4UPU "Crystal Structure Of Ip3 3-k Calmodulin Binding Region In Complex With Calmodulin" 100.00 148 99.32 100.00 9.29e-100 PDB 4V0C "Crystal Structure Of The Kv7.1 Proximal C-terminal Domain In Complex With Calmodulin" 100.00 149 99.32 100.00 1.17e-99 DBJ BAA08302 "calmodulin [Homo sapiens]" 100.00 149 99.32 100.00 1.17e-99 DBJ BAA11896 "calmodulin [Anas platyrhynchos]" 100.00 149 99.32 100.00 1.17e-99 DBJ BAA19786 "calmodulin [Branchiostoma lanceolatum]" 100.00 149 97.30 99.32 1.32e-97 DBJ BAA19787 "calmodulin [Branchiostoma floridae]" 100.00 149 97.30 99.32 1.32e-97 DBJ BAA19788 "calmodulin [Halocynthia roretzi]" 100.00 149 97.30 99.32 1.32e-97 EMBL CAA10601 "calmodulin [Caenorhabditis elegans]" 100.00 149 97.30 98.65 3.46e-97 EMBL CAA32050 "calmodulin [Rattus norvegicus]" 100.00 149 99.32 100.00 1.17e-99 EMBL CAA32062 "calmodulin II [Rattus norvegicus]" 100.00 149 99.32 100.00 1.17e-99 EMBL CAA32119 "calmodulin [Rattus norvegicus]" 100.00 149 99.32 100.00 1.17e-99 EMBL CAA32120 "calmodulin [Rattus norvegicus]" 100.00 149 99.32 100.00 1.17e-99 GB AAA35635 "calmodulin [Homo sapiens]" 100.00 149 99.32 100.00 1.17e-99 GB AAA35641 "calmodulin [Homo sapiens]" 100.00 149 99.32 100.00 1.17e-99 GB AAA37365 "calmodulin synthesis [Mus musculus]" 100.00 149 99.32 100.00 1.17e-99 GB AAA40862 "calmodulin [Rattus norvegicus]" 100.00 149 99.32 100.00 1.17e-99 GB AAA40863 "calmodulin [Rattus norvegicus]" 100.00 149 99.32 100.00 1.17e-99 PIR JC1305 "calmodulin - Japanese medaka" 100.00 149 99.32 100.00 1.17e-99 PIR MCON "calmodulin - salmon" 100.00 148 99.32 100.00 9.29e-100 PRF 0608335A calmodulin 100.00 148 97.30 99.32 6.89e-97 REF NP_001008160 "calmodulin [Xenopus (Silurana) tropicalis]" 100.00 149 99.32 100.00 1.17e-99 REF NP_001009759 "calmodulin [Ovis aries]" 100.00 149 99.32 100.00 1.17e-99 REF NP_001039714 "calmodulin [Bos taurus]" 100.00 149 99.32 100.00 1.17e-99 REF NP_001040234 "calmodulin [Bombyx mori]" 100.00 149 97.30 99.32 1.32e-97 REF NP_001080864 "calmodulin [Xenopus laevis]" 100.00 149 99.32 100.00 1.17e-99 SP O16305 "RecName: Full=Calmodulin; Short=CaM" 100.00 149 97.30 98.65 3.46e-97 SP P02594 "RecName: Full=Calmodulin; Short=CaM" 100.00 149 98.65 100.00 4.11e-99 SP P21251 "RecName: Full=Calmodulin; Short=CaM" 100.00 149 97.97 99.32 2.78e-98 SP P62144 "RecName: Full=Calmodulin; Short=CaM" 100.00 149 99.32 100.00 1.17e-99 SP P62145 "RecName: Full=Calmodulin; Short=CaM [Aplysia californica]" 100.00 149 97.30 99.32 1.32e-97 TPG DAA13808 "TPA: calmodulin 2-like [Bos taurus]" 100.00 216 97.97 98.65 5.67e-98 TPG DAA18029 "TPA: calmodulin [Bos taurus]" 100.00 149 97.97 99.32 2.21e-98 TPG DAA19590 "TPA: calmodulin 3 [Bos taurus]" 100.00 149 99.32 100.00 1.17e-99 TPG DAA24777 "TPA: calmodulin 2-like [Bos taurus]" 100.00 149 99.32 100.00 1.17e-99 TPG DAA24988 "TPA: calmodulin 2-like isoform 1 [Bos taurus]" 100.00 149 99.32 100.00 1.17e-99 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $calmodulin chicken 9031 Eukaryota Metazoa Gallus gallus 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 $calmodulin 'recombinant technology' . Escherichia coli . pET stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details 'Uniform 15N labeled CaM for backbone relaxation experiments' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $calmodulin 1 mM '[U-100% 15N]' 'potassium chloride' 100 mM 'natural abundance' imidazole 20 mM 'natural abundance' CaCl2 6 mM 'natural abundance' 'sodium azide' 3 mM 'natural abundance' stop_ save_ save_sample_2 _Saveframe_category sample _Sample_type solution _Details 'Uniform 15N/13C;55% 2H labeled CaM for methyl relaxation experiments' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $calmodulin 1 mM '[U-100% 13C; U-100% 15N; 55% 2H]' 'potassium chloride' 100 mM 'natural abundance' imidazole 20 mM 'natural abundance' CaCl2 6 mM 'natural abundance' 'sodium azide' 3 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_Felix _Saveframe_category software _Name FELIX _Version . loop_ _Vendor _Address _Electronic_address 'Accelrys Software Inc.' . . stop_ loop_ _Task processing stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 500 _Details . save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 600 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_1 save_ save_2D_1H-15N_HSQC_2 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_1 save_ save_2D_1H-13C_HSQC_3 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C HSQC' _Sample_label $sample_2 save_ save_2D_1H-13C_HSQC_4 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C HSQC' _Sample_label $sample_2 save_ save_2D_1H-15N_HSQC _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _BMRB_pulse_sequence_accession_number . _Details 'T1 and T2 experiments were collected as 12 HSQC - 9 delay times, 3 of which were collected in duplicate.' save_ save_2D_1H-13C_HSQC _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C HSQC' _BMRB_pulse_sequence_accession_number . _Details 'methyl relaxation experiments were collected as 11 HSQC - 9 delay times, 2 of which were collected in duplicate.' save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details '20mM imidazole, pH 6.5, 100mM KCl, 6mM CaCl2, 3 mM Na_azide' loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 6.5 . pH pressure 1 . atm temperature 308 . K stop_ save_ save_backbone_order_parameters _Saveframe_category S2_parameters _Details 'NMR derived backbone N-H bond vector model-free squared generalized order parameters for calcium-saturated CaM determined at 500 and 600 MHz (1H)' loop_ _Software_label $Felix stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_conditions_1 _Mol_system_component_name calmodulin _Tau_e_value_units s _Text_data_format . _Text_data . loop_ _Residue_seq_code _Residue_label _Atom_name _Model_fit _S2_value _S2_value_fit_error _Tau_e_value _Tau_e_value_fit_error _S2f_value _S2f_value_fit_error _S2s_value _S2s_value_fit_error _Tau_s_value _Tau_s_value_fit_error _S2H_value _S2H_value_fit_error _S2N_value _S2N_value_fit_error 4 LEU N . 0.636 0.005 1.10E-10 6.00E-12 . . . . . . . . . . 6 GLU N . 0.92 0.01 1.33E-10 1.07E-10 . . . . . . . . . . 7 GLU N . 0.929 0.003 5.67E-10 1.92E-10 . . . . . . . . . . 8 GLN N . 0.901 0.004 9.28E-10 1.59E-10 . . . . . . . . . . 13 LYS N . 0.967 0.004 3.37E-10 4.04E-11 . . . . . . . . . . 15 ALA N . 0.972 0.003 3.03E-10 6.01E-11 . . . . . . . . . . 16 PHE N . 0.967 0.015 8.22E-11 1.16E-10 . . . . . . . . . . 17 SER N . 0.981 0.005 3.03E-10 5.12E-11 . . . . . . . . . . 18 LEU N . 0.972 0.005 2.74E-10 6.29E-11 . . . . . . . . . . 19 PHE N . 1 0 5.00E-14 1.16E-10 . . . . . . . . . . 20 ASP N . 0.967 0.009 1.96E-10 8.61E-11 . . . . . . . . . . 21 LYS N . 0.896 0.011 8.61E-11 3.27E-11 . . . . . . . . . . 22 ASP N . 0.91 0.005 1.00E-09 1.74E-10 . . . . . . . . . . 24 ASP N . 0.934 0.005 1.00E-09 2.62E-10 . . . . . . . . . . 26 THR N . 0.962 0.005 4.52E-10 1.69E-10 . . . . . . . . . . 27 ILE N . 0.972 0.008 3.41E-10 1.19E-10 . . . . . . . . . . 28 THR N . 0.924 0.008 1.00E-09 0.00E+00 . . . . . . . . . . 29 THR N . 0.934 0.007 1.00E-09 2.65E-10 . . . . . . . . . . 30 LYS N . 0.948 0.005 9.43E-10 3.79E-10 . . . . . . . . . . 32 LEU N . 0.915 0.007 1.00E-09 0.00E+00 . . . . . . . . . . 33 GLY N . 0.901 0.007 1.00E-09 0.00E+00 . . . . . . . . . . 34 THR N . 0.915 0.003 8.45E-10 1.77E-10 . . . . . . . . . . 35 VAL N . 0.91 0.006 1.00E-09 0.00E+00 . . . . . . . . . . 37 ARG N . 0.905 0.006 1.00E-09 7.65E-11 . . . . . . . . . . 39 LEU N . 1 0 3.68E-10 0.00E+00 . . . . . . . . . . 42 ASN N . 0.74 0.04 4.11E-11 2.32E-11 . . . . . . . . . . 46 ALA N . 0.896 0.005 1.00E-09 0.00E+00 . . . . . . . . . . 47 GLU N . 0.948 0.005 2.04E-10 8.04E-11 . . . . . . . . . . 48 LEU N . 0.92 0.004 7.42E-10 2.71E-10 . . . . . . . . . . 52 ILE N . 0.943 0.004 8.37E-10 3.64E-10 . . . . . . . . . . 54 GLU N . 0.891 0 8.34E-10 3.91E-11 . . . . . . . . . . 57 ALA N . 0.74 0.01 3.53E-11 5.45E-12 . . . . . . . . . . 58 ASP N . 0.868 0.007 1.00E-09 3.18E-10 . . . . . . . . . . 61 GLY N . 0.929 0.006 9.59E-10 6.02E-10 . . . . . . . . . . 63 ILE N . 0.915 0.007 1.00E-09 2.33E-10 . . . . . . . . . . 64 ASP N . 0.896 0.008 1.00E-09 3.29E-10 . . . . . . . . . . 65 PHE N . 0.953 0.01 2.76E-10 1.02E-10 . . . . . . . . . . 68 PHE N . 0.924 0.007 1.00E-09 5.16E-10 . . . . . . . . . . 69 LEU N . 1 0.002 2.96E-10 7.98E-11 . . . . . . . . . . 70 THR N . 1 0 5.00E-14 4.20E-12 . . . . . . . . . . 78 ASP N . 0.731 0.019 1.53E-10 5.18E-11 . . . . . . . . . . 80 ASP N . 0.74 0.019 9.79E-11 2.36E-11 . . . . . . . . . . 81 SER N . 0.759 0.033 8.81E-11 4.40E-11 . . . . . . . . . . 84 GLU N . 0.91 0.015 8.61E-11 4.67E-10 . . . . . . . . . . 86 ARG N . 0.957 0.007 1.70E-10 7.37E-11 . . . . . . . . . . 89 PHE N . 0.967 0.005 2.51E-10 5.75E-11 . . . . . . . . . . 90 ARG N . 0.986 0.006 2.51E-10 8.88E-11 . . . . . . . . . . 91 VAL N . 0.939 0.005 2.45E-10 9.81E-11 . . . . . . . . . . 93 ASP N . 0.929 0.01 8.42E-11 3.92E-11 . . . . . . . . . . 94 LYS N . 0.896 0.009 6.46E-11 3.34E-10 . . . . . . . . . . 95 ASP N . 0.858 0.005 1.00E-09 0.00E+00 . . . . . . . . . . 96 GLY N . 0.877 0.005 1.00E-09 1.35E-10 . . . . . . . . . . 99 TYR N . 0.896 0.005 1.00E-09 2.04E-10 . . . . . . . . . . 100 ILE N . 0.872 0.009 1.00E-09 5.23E-10 . . . . . . . . . . 101 SER N . 0.915 0.006 1.00E-09 7.97E-11 . . . . . . . . . . 102 ALA N . 0.877 0.005 1.00E-09 7.66E-11 . . . . . . . . . . 105 LEU N . 0.891 0.005 1.00E-09 0.00E+00 . . . . . . . . . . 109 MET N . 0.967 0.004 3.62E-10 7.12E-12 . . . . . . . . . . 110 THR N . 0.882 0.005 1.00E-09 7.66E-11 . . . . . . . . . . 111 ASN N . 0.896 0.007 1.00E-09 7.71E-11 . . . . . . . . . . 114 GLU N . 0.783 0.011 1.00E-09 1.67E-10 . . . . . . . . . . 115 LYS N . 0.683 0.009 1.13E-10 1.12E-11 . . . . . . . . . . 116 LEU N . 0.655 0.005 6.66E-11 4.03E-12 . . . . . . . . . . 117 THR N . 0.839 0.03 8.61E-11 5.35E-10 . . . . . . . . . . 121 VAL N . 0.943 0.006 1.96E-10 1.04E-10 . . . . . . . . . . 125 ILE N . 0.929 0.007 1.21E-10 6.15E-11 . . . . . . . . . . 127 GLU N . 0.905 0.003 7.40E-10 8.15E-11 . . . . . . . . . . 128 ALA N . 0.915 0.009 9.20E-11 4.63E-11 . . . . . . . . . . 130 ILE N . 0.683 0.008 3.14E-11 3.62E-12 . . . . . . . . . . 131 ASP N . 0.863 0.005 1.00E-09 0.00E+00 . . . . . . . . . . 133 ASP N . 0.92 0.01 7.83E-11 3.09E-11 . . . . . . . . . . 134 GLY N . 0.905 0.006 1.00E-09 3.59E-10 . . . . . . . . . . 135 GLN N . 0.887 0.004 1.00E-09 0.00E+00 . . . . . . . . . . 136 VAL N . 0.877 0.008 1.00E-09 2.82E-10 . . . . . . . . . . 137 ASN N . 0.877 0.008 1.00E-09 1.36E-10 . . . . . . . . . . 140 GLU N . 0.915 0.005 1.00E-09 7.90E-11 . . . . . . . . . . 141 PHE N . 0.882 0.006 1.00E-09 0.00E+00 . . . . . . . . . . 143 GLN N . 0.896 0.005 1.00E-09 1.36E-10 . . . . . . . . . . 145 MET N . 0.887 0.004 9.63E-10 1.36E-10 . . . . . . . . . . 146 THR N . 0.943 0.005 3.03E-10 1.01E-11 . . . . . . . . . . 147 ALA N . 0.679 0.042 1.00E-09 4.29E-10 . . . . . . . . . . 148 LYS N . 0.646 0.004 5.00E-14 0.00E+00 . . . . . . . . . . stop_ _Tau_s_value_units s save_ save_methyl_order_parameters _Saveframe_category S2_parameters _Details 'NMR derived side-chain model-free squared generalized order parameters for the symmetry axis of methyl groups of calcium-saturated CaM determined with relaxation data obtained at 500 and 600 MHz (1H).' loop_ _Software_label $Felix stop_ loop_ _Sample_label $sample_2 stop_ _Sample_conditions_label $sample_conditions_1 _Mol_system_component_name calmodulin _Tau_e_value_units s _Text_data_format . _Text_data . loop_ _Residue_seq_code _Residue_label _Atom_name _Model_fit _S2_value _S2_value_fit_error _Tau_e_value _Tau_e_value_fit_error _S2f_value _S2f_value_fit_error _S2s_value _S2s_value_fit_error _Tau_s_value _Tau_s_value_fit_error _S2H_value _S2H_value_fit_error _S2N_value _S2N_value_fit_error 4 LEU CD1 . 0.412 0.018 4.90E-11 3.12E-12 . . . . . . . . . . 9 ILE CD1 . 0.39 0.007 2.21E-11 6.58E-13 . . . . . . . . . . 9 ILE CG2 . 0.786 0.018 2.71E-11 8.84E-13 . . . . . . . . . . 10 ALA CB . 0.793 0.016 3.84E-11 1.05E-12 . . . . . . . . . . 15 ALA CB . 0.934 0.042 6.47E-11 3.75E-12 . . . . . . . . . . 18 LEU CD1 . 0.171 0.004 3.84E-11 6.50E-13 . . . . . . . . . . 18 LEU CD2 . 0.256 0.004 3.84E-11 6.58E-13 . . . . . . . . . . 26 THR CG2 . 0.489 0.008 9.55E-11 2.92E-12 . . . . . . . . . . 27 ILE CG2 . 0.617 0.021 3.84E-11 1.79E-12 . . . . . . . . . . 29 THR CG2 . 0.376 0.006 6.72E-11 1.93E-12 . . . . . . . . . . 32 LEU CD1 . 0.32 0.006 3.33E-11 9.56E-13 . . . . . . . . . . 32 LEU CD2 . 0.256 0.012 3.40E-11 2.15E-12 . . . . . . . . . . 35 VAL CG2 . 0.687 0.017 2.58E-11 9.98E-13 . . . . . . . . . . 36 MET CE . 0.249 0.002 9.51E-12 2.67E-13 . . . . . . . . . . 51 MET CE . 0.171 0.005 9.51E-12 3.60E-13 . . . . . . . . . . 52 ILE CD1 . 0.334 0.006 1.95E-11 6.52E-13 . . . . . . . . . . 52 ILE CG2 . 0.673 0.017 4.03E-11 1.34E-12 . . . . . . . . . . 55 VAL CG1 . 0.567 0.013 4.90E-11 1.46E-12 . . . . . . . . . . 55 VAL CG2 . 0.567 0.013 4.09E-11 1.46E-12 . . . . . . . . . . 62 THR CG2 . 0.793 0.033 1.10E-10 7.07E-12 . . . . . . . . . . 63 ILE CD1 . 0.504 0.012 3.02E-11 1.09E-12 . . . . . . . . . . 63 ILE CG2 . 0.715 0.021 2.71E-11 1.27E-12 . . . . . . . . . . 69 LEU CD1 . 0.355 0.017 4.59E-11 3.08E-12 . . . . . . . . . . 70 THR CG2 . 0.595 0.012 5.41E-11 1.48E-12 . . . . . . . . . . 71 MET CE . 0.164 0.004 8.26E-12 1.71E-13 . . . . . . . . . . 72 MET CE . 0.277 0.003 8.26E-12 2.57E-13 . . . . . . . . . . 76 MET CE . 0.094 0.003 8.88E-12 0.00E+00 . . . . . . . . . . 85 ILE CD1 . 0.32 0.005 2.52E-11 5.01E-13 . . . . . . . . . . 85 ILE CG2 . 0.553 0.009 3.15E-11 8.48E-13 . . . . . . . . . . 88 ALA CB . 0.836 0.029 7.16E-11 3.62E-12 . . . . . . . . . . 91 VAL CG1 . 0.68 0.015 5.03E-11 1.38E-12 . . . . . . . . . . 91 VAL CG2 . 0.68 0.012 2.77E-11 7.57E-13 . . . . . . . . . . 100 ILE CG2 . 0.737 0.022 3.40E-11 1.55E-12 . . . . . . . . . . 102 ALA CB . 0.949 0.025 3.71E-11 1.25E-12 . . . . . . . . . . 109 MET CE . 0.136 0.005 8.88E-12 5.14E-14 . . . . . . . . . . 116 LEU CD1 . 0.285 0.01 5.78E-11 3.32E-12 . . . . . . . . . . 116 LEU CD2 . 0.299 0.005 3.52E-11 8.57E-13 . . . . . . . . . . 121 VAL CG1 . 0.553 0.008 4.28E-11 9.93E-13 . . . . . . . . . . 121 VAL CG2 . 0.553 0.009 3.71E-11 8.46E-13 . . . . . . . . . . 124 MET CE . 0.186 0.001 7.00E-12 3.17E-13 . . . . . . . . . . 125 ILE CD1 . 0.207 0.003 2.90E-11 5.68E-13 . . . . . . . . . . 125 ILE CG2 . 0.567 0.008 4.15E-11 9.56E-13 . . . . . . . . . . 128 ALA CB . 0.779 0.018 6.22E-11 2.04E-12 . . . . . . . . . . 130 ILE CG1 . 0.327 0.005 2.71E-11 5.27E-13 . . . . . . . . . . 130 ILE CG2 . 0.489 0.006 4.09E-11 7.22E-13 . . . . . . . . . . 136 VAL CG2 . 0.723 0.018 4.65E-11 1.71E-12 . . . . . . . . . . 142 VAL CG1 . 0.715 0.014 5.28E-11 1.50E-12 . . . . . . . . . . 142 VAL CG2 . 0.61 0.011 2.83E-11 7.52E-13 . . . . . . . . . . 144 MET CE . 0.115 0 9.51E-12 3.64E-13 . . . . . . . . . . 145 MET CE . 0.2 0.001 8.26E-12 4.18E-13 . . . . . . . . . . 146 THR CG2 . 0.433 0.005 5.28E-11 9.68E-13 . . . . . . . . . . 147 ALA CB . 0.327 0.005 4.21E-11 4.30E-13 . . . . . . . . . . stop_ _Tau_s_value_units s save_