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●I-TASSER ●I-TASSER-MTD ●C-I-TASSER ●CR-I-TASSER ●QUARK ●C-QUARK ●LOMETS ●MUSTER ●CEthreader ●SEGMER ●DeepFold ●DeepFoldRNA ●FoldDesign ●COFACTOR ●COACH ●MetaGO ●TripletGO ●IonCom ●FG-MD ●ModRefiner ●REMO ●DEMO ●DEMO-EM ●SPRING ●COTH ●Threpp ●PEPPI ●BSpred ●ANGLOR ●EDock ●BSP-SLIM ●SAXSTER ●FUpred ●ThreaDom ●ThreaDomEx ●EvoDesign ●BindProf ●BindProfX ●SSIPe ●GPCR-I-TASSER ●MAGELLAN ●ResQ ●STRUM ●DAMpred

●TM-score ●TM-align ●US-align ●MM-align ●RNA-align ●NW-align ●LS-align ●EDTSurf ●MVP ●MVP-Fit ●SPICKER ●HAAD ●PSSpred ●3DRobot ●MR-REX ●I-TASSER-MR ●SVMSEQ ●NeBcon ●ResPRE ●TripletRes ●DeepPotential ●WDL-RF ●ATPbind ●DockRMSD ●DeepMSA ●FASPR ●EM-Refiner ●GPU-I-TASSER

●BioLiP ●E. coli ●GLASS ●GPCR-HGmod ●GPCR-RD ●GPCR-EXP ●Tara-3D ●TM-fold ●DECOYS ●POTENTIAL ●RW/RWplus ●EvoEF ●HPSF ●THE-DB ●ADDRESS ●Alpaca-Antibody ●CASP7 ●CASP8 ●CASP9 ●CASP10 ●CASP11 ●CASP12 ●CASP13 ●CASP14

Structure of PDB 9avl Chain R Binding Site BS01

Receptor Information >9avl Chain R (length=824) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure] GPDQRAQKKGDIILGGLFPIHFGVAAKDQDLKSRPESVECIRYNFRGFRW LQAMIFAIEEINSSPALLPNLTLGYRIFDTCNTVSKALEATLSFVAQNKI DSLNCSEHIPSTIAVVGATGSGVSTAVANLLGLFYIPQVSYASSSRLLSN KNQFKSFLRTIPNDEHQATAMADIIEYFRWNWVGTIAADDDYGRPGIEKF REEAEERDICIDFSELISQYSDEEEIQHVVEVIQNSTAKVIVVFSSGPDL EPLIKEIVRRNITGKIWLASEAWASSSLIAMPQYFHVVGGTIGFALKAGQ IPGFREFLKKVHPRKSVHNGFAKEFWEETFNCHLRPLCTGDENISSVETP YIDYTHLRISYNVYLAVYSIAHALQDIYTCLPGRGLFTNGSCADIKKVEA WQVLKHLRHLNFTNNMGEQVTFDECGDLVGNYSIINWHLSPEDGSIVFKE VGYYNVYAKKGERLFINEEKILWSGFSREVPFSNCSRDCLAGTRKGIIEG EPTCCFECVECPDGEYSDETDASACNKCPDDFWSNENHTSCIAKEIEFLS WTEPFGIALTLFAVLGIFLTAFVLGVFIKFRNTPIVKATNRELSYLLLFS LLCCFSSSLFFIGEPQDWTCRLRQPAFGISFVLCISCILVKTNRVLLVFE AKIPTSFHRKWWGLNLQFLLVFLCTFMQIVICVIWLYTAPPSSYRNQELE DEIIFITCHEGSLMALGFLIGYTCLLAAICFFFAFKSRKLPENFNEAKFI TFSMLIFFIVWISFIPAYASTYGKFVSAVEVIAILAASFGLLACIFFNKI YIILFKPSRNTIEEVRCSTAAHAF

Ligand information Ligand ID TCR InChI InChI=1S/C12H12N2O2/c15-12(16)10-5-8-7-3-1-2-4-9(7)14-11(8)6-13-10/h1-4,10,13-14H,5-6H2,(H,15,16)/t10-/m0/s1 InChIKey FSNCEEGOMTYXKY-JTQLQIEISA-N SMILES Software SMILES CACTVS 3.370 OC(=O)[CH]1Cc2c(CN1)[nH]c3ccccc23 OpenEye OEToolkits 1.7.0 c1ccc2c(c1)c3c([nH]2)CN[C@@H](C3)C(=O)O CACTVS 3.370 OC(=O)[C@@H]1Cc2c(CN1)[nH]c3ccccc23 ACDLabs 12.01 O=C(O)C3NCc1c(c2c(n1)cccc2)C3 OpenEye OEToolkits 1.7.0 c1ccc2c(c1)c3c([nH]2)CNC(C3)C(=O)O Formula C12 H12 N2 O2 Name CYCLOMETHYLTRYPTOPHAN ChEMBL CHEMBL155546 DrugBank ZINC ZINC000000037835 PDB chain 9avl Chain R Residue 1004 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]

Receptor-Ligand Complex Structure Global view Local view Structure summary [Spin on] [Spin off] [Reset] [High quality] [Low quality] [White background] [Black background] [Spin on] [Spin off] [Reset] [High quality] [Low quality] [White background] [Black background] PDB 9avl Promiscuous G-protein activation by the calcium-sensing receptor Resolution 3.8 Å Binding residue (original residue number in PDB) S147 A168 S170 Y218 E297 Binding residue (residue number reindexed from 1) S121 A142 S144 Y192 E271 Annotation score 1

Enzymatic activity Enzyme Commision number ?

Gene Ontology Molecular Function GO:0004930 G protein-coupled receptor activity

	Biological Process
GO:0007186	G protein-coupled receptor signaling pathway

	Cellular Component
GO:0016020	membrane

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