Structure of PDB 8uc9 Chain A Binding Site BS01

Receptor Information
>8uc9 Chain A (length=457) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
QLRLPSPEVYRFVVKDSEENIVFEIPIIKGGTVVKLIERLTYHMYADPNF
VRTFLTTYRSFCKPQELLSLLIERFEIPEPEAIEKGEQPISADLKRFRKE
YVQPVQLRILNVFRHWVEHHFYDFERDLYLLERLESFISSVRGKAMKKWV
ESIAKIIRRKKQAQANGVSTFESPPPPIEWHISKPGHIETFDLMTLHPIE
IARQLTLLESDLYRKVQPSELVGSVWTKEDKEINSPNLLKMIRHTTNLTL
WFEKCIVEAENFEERVAVLSRIIEILQVFQDLNNFNGVLEIVSAVNSVSV
YRLDHTFEALQERKRKILDEAVELSQFKKYLVKLKSINPPCVPFFGIYLT
NILKTEEGNNDFLTRHGKDLINFSKRRKVAEITGEIQQYQNQPYCLRIEP
DMRRFFENLNPMGSASEKEFTDYLFNKSLEIEPRNPKQPPRFPRKSTFSL
KSPGIRP
Ligand information
Ligand IDQBC
InChIInChI=1S/C9H7ClN2/c10-6-1-2-7-8(11)3-4-12-9(7)5-6/h1-5H,(H2,11,12)
InChIKeyNDRZSRWMMUGOBP-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 2.0.7c1cc2c(ccnc2cc1Cl)N
CACTVS 3.385Nc1ccnc2cc(Cl)ccc12
ACDLabs 12.01Clc1cc2nccc(N)c2cc1
FormulaC9 H7 Cl N2
Name7-chloroquinolin-4-amine
ChEMBLCHEMBL44789
DrugBank
ZINCZINC000000436635
PDB chain8uc9 Chain A Residue 1101 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB8uc9 Discovery of Five SOS2 Fragment Hits with Binding Modes Determined by SOS2 X-Ray Cocrystallography.
Resolution2.44 Å
Binding residue
(original residue number in PDB)		Y882 D885 F888 L899
Binding residue
(residue number reindexed from 1)		Y301 D304 F307 L318
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0005085 guanyl-nucleotide exchange factor activity
Biological Process
GO:0007264 small GTPase-mediated signal transduction

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Molecular Function
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Biological Process
External links
PDB RCSB:8uc9, PDBe:8uc9, PDBj:8uc9
PDBsum8uc9
PubMed38156904
UniProtQ07890|SOS2_HUMAN Son of sevenless homolog 2 (Gene Name=SOS2)

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