Structure of PDB 5s85 Chain A Binding Site BS05
Receptor Information
>5s85 Chain A (length=282) Species:
9606
(Homo sapiens) [
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RTVARDITLLCVGKGRYGEVWRGSWQGENVAVKIFSSRDEKSWFRETELY
NTVMLRHENILGFIASDMTSRHSSTQLWLITHYHEMGSLYDYLQLTTLDT
VSCLRIVLSIASGLAHLHIEIFGGKPAIAHRDLKSKNILVKKNGQCCIAD
LGLAVMHRVGTKRYMAPEVLDETIQVDCFDSYKRVDIWAFGLVLWEVARR
MVSNGIVEDYKPPFYDVVPNDPSFEDMRKVVCVDQQRPNIPNRWFSDPTL
TSLAKLMKECWYQNPSARLTALRIKKTLTKID
Ligand information
Ligand ID
XK4
InChI
InChI=1S/C3H8N2O/c4-3-1-2-6-5-3/h3,5H,1-2,4H2/t3-/m1/s1
InChIKey
IRMAFFLFVPYKOZ-GSVOUGTGSA-N
SMILES
Software
SMILES
OpenEye OEToolkits 2.0.7
C1CONC1N
OpenEye OEToolkits 2.0.7
C1CON[C@H]1N
CACTVS 3.385
N[C@H]1CCON1
ACDLabs 12.01
NC1NOCC1
CACTVS 3.385
N[CH]1CCON1
Formula
C3 H8 N2 O
Name
(3R)-1,2-oxazolidin-3-amine
ChEMBL
DrugBank
ZINC
PDB chain
5s85 Chain A Residue 510 [
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Receptor-Ligand Complex Structure
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PDB
5s85
XChem group deposition
Resolution
1.33 Å
Binding residue
(original residue number in PDB)
V376 F441
Binding residue
(residue number reindexed from 1)
V159 F224
Annotation score
1
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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Cellular Component
External links
PDB
RCSB:5s85
,
PDBe:5s85
,
PDBj:5s85
PDBsum
5s85
PubMed
UniProt
Q04771
|ACVR1_HUMAN Activin receptor type-1 (Gene Name=ACVR1)
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