Structure of PDB 8oso Chain A Binding Site BS02

Receptor Information
>8oso Chain A (length=166) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MTEYKLVVVGAGGVGKSALTIQLIQNHFVDEYDPTIEDSYRKQVVIDGET
CLLDILDTAGQEEYSAMRDQYMRTGEGFLCVFAINNTKSFEDIHQYREQI
KRVKDSDDVPMVLVGNKCDLAARTVESRQAQDLARSYGIPYIETSAKTRQ
GVEDAFYTLVREIRQH
Ligand information
Ligand IDYCN
InChIInChI=1S/C8H20N4/c1-2-10-5-6-12-8-7-11-4-3-9-1/h9-12H,1-8H2
InChIKeyQBPPRVHXOZRESW-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.352
OpenEye OEToolkits 1.7.0		C1CNCCNCCNCCN1
FormulaC8 H20 N4
Name1,4,7,10-tetraazacyclododecane;
Cyclen
ChEMBLCHEMBL19880
DrugBank
ZINCZINC000005850273
PDB chain8oso Chain A Residue 204 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB8oso High pressure promotes binding of the allosteric inhibitor Zn2+-cyclen in crystals of activated H-Ras.
Resolution2.5 Å
Binding residue
(original residue number in PDB)		T35 Q61 Y64
Binding residue
(residue number reindexed from 1)		T35 Q61 Y64
Annotation score1
Enzymatic activity
Enzyme Commision number 3.6.5.2: small monomeric GTPase.
Gene Ontology
Molecular Function
GO:0003924 GTPase activity
GO:0005525 GTP binding
Biological Process
GO:0007165 signal transduction
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:8oso, PDBe:8oso, PDBj:8oso
PDBsum8oso
PubMed38647362
UniProtP01112|RASH_HUMAN GTPase HRas (Gene Name=HRAS)

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