Structure of PDB 8uh0 Chain A Binding Site BS01

Receptor Information
>8uh0 Chain A (length=440) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
LRLPSPEVYRFVVKDSEENIVFIPIIKGGTVVKLIERLTYHMYADPNFVR
TFLTTYRSFCKPQELLSLLIERFEIPEPELKRFRKEYVQPVQLRILNVFR
HWVEHHFYDFERDLYLLERLESFISSVRGKAMKKWVESIAKIIRRKKQAQ
ITFESPPPPIEWHISKPGHIETFDLMTLHPIEIARQLTLLESDLYRKVQP
SELVGSVWTKEDKEINSPNLLKMIRHTTNLTLWFEKCIVEAENFEERVAV
LSRIIEILQVFQDLNNFNGVLEIVSAVNSVSVYRLDHTFEALQERKRKIL
DEAVELSQDHFKKYLVKLKSINPPCVPFFGIYLTNILKTEEGNNDFLTGK
DLINFSKRRKVAEITGEIQQYQNQPYCLRIEPDMRRFFENLNPMGSASEK
EFTDYLFNKSLEIEPRNPKQPPRFPRKSTFSLKSPGIRPN
Ligand information
Ligand IDWRN
InChIInChI=1S/C10H6N2O/c11-6-8-5-4-7-2-1-3-9(13)10(7)12-8/h1-5,13H
InChIKeyKUQKKIBQVSFDHX-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 2.0.7c1cc2ccc(nc2c(c1)O)C#N
CACTVS 3.385Oc1cccc2ccc(nc12)C#N
ACDLabs 12.01Oc1cccc2ccc(C#N)nc12
FormulaC10 H6 N2 O
Name8-hydroxyquinoline-2-carbonitrile
ChEMBLCHEMBL2321985
DrugBank
ZINCZINC000000156915
PDB chain8uh0 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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PDB8uh0 Discovery of Five SOS2 Fragment Hits with Binding Modes Determined by SOS2 X-Ray Cocrystallography.
Resolution2.73 Å
Binding residue
(original residue number in PDB)		Y882 D885 F888 D900
Binding residue
(residue number reindexed from 1)		Y283 D286 F289 D301
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:8uh0, PDBe:8uh0, PDBj:8uh0
PDBsum8uh0
PubMed38156904
UniProtQ07890|SOS2_HUMAN Son of sevenless homolog 2 (Gene Name=SOS2)

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