Structure of PDB 5s84 Chain A Binding Site BS04

Receptor Information
>5s84 Chain A (length=284) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
QRTVARDITLLECVGKGRYGEVWRGSWQGENVAVKIFSSRDEKSWFRETE
LYNTVMLRHENILGFIASDMTSRHSSTQLWLITHYHEMGSLYDYLQLTTL
DTVSCLRIVLSIASGLAHLHIEIFGGKPAIAHRDLKSKNILVKKNGQCCI
ADLGLAVMHRVGTKRYMAPEVLDETIQVDCFDSYKRVDIWAFGLVLWEVA
RRMVSNGIVEDYKPPFYDVVPNDPSFEDMRKVVCVDQQRPNIPNRWFSDP
TLTSLAKLMKECWYQNPSARLTALRIKKTLTKID
Ligand information
Ligand IDXK1
InChIInChI=1S/C4H10N2O/c5-1-4-2-7-3-6-4/h4,6H,1-3,5H2/t4-/m1/s1
InChIKeyJUAFUPTWZIUUQO-SCSAIBSYSA-N
SMILES
SoftwareSMILES
CACTVS 3.385NC[CH]1COCN1
ACDLabs 12.01NCC1NCOC1
CACTVS 3.385NC[C@@H]1COCN1
OpenEye OEToolkits 2.0.7C1C(NCO1)CN
OpenEye OEToolkits 2.0.7C1[C@H](NCO1)CN
FormulaC4 H10 N2 O
Name1-[(4R)-1,3-oxazolidin-4-yl]methanamine
ChEMBL
DrugBank
ZINC
PDB chain5s84 Chain A Residue 509 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5s84 XChem group deposition
Resolution1.35 Å
Binding residue
(original residue number in PDB)		E230 H284
Binding residue
(residue number reindexed from 1)		E30 H84
Annotation score1
Enzymatic activity
Enzyme Commision number 2.7.11.30: receptor protein serine/threonine kinase.
Gene Ontology
Molecular Function
GO:0004672 protein kinase activity
GO:0004675 transmembrane receptor protein serine/threonine kinase activity
GO:0005524 ATP binding
Biological Process
GO:0006468 protein phosphorylation
GO:0007178 cell surface receptor protein serine/threonine kinase signaling pathway
Cellular Component
GO:0016020 membrane

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:5s84, PDBe:5s84, PDBj:5s84
PDBsum5s84
PubMed
UniProtQ04771|ACVR1_HUMAN Activin receptor type-1 (Gene Name=ACVR1)

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