Structure of PDB 7z9y Chain AAA Binding Site BS02

Receptor Information
>7z9y Chain AAA (length=129) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GSHMNPPPPETSNPNKPKRQTNQLQYLLRVVLKTLWKHQFAWPFQQPVDA
VKLNLPDYYKIIKTPMDMGTIKKRLENNYYWNAQECIQDFNTMFTNCYIY
NKPGDDIVLMAEALEKLFLQKINELPTEE
Ligand information
Ligand IDPYZ
InChIInChI=1S/C3H3IN2/c4-3-1-5-6-2-3/h1-2H,(H,5,6)
InChIKeyLLNQWPTUJJYTTE-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04Ic1cnnc1
OpenEye OEToolkits 1.5.0c1c(cn[nH]1)I
CACTVS 3.341Ic1c[nH]nc1
FormulaC3 H3 I N2
Name4-IODOPYRAZOLE
ChEMBL
DrugBankDB02721
ZINCZINC000002046962
PDB chain7z9y Chain AAA Residue 205 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB7z9y Mapping Ligand Interactions of Bromodomains BRD4 and ATAD2 with FragLites and PepLites─Halogenated Probes of Druglike and Peptide-like Molecular Interactions.
Resolution1.04 Å
Binding residue
(original residue number in PDB)		M43 A89 V90 P95
Binding residue
(residue number reindexed from 1)		M4 A50 V51 P56
Annotation score1
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:7z9y, PDBe:7z9y, PDBj:7z9y
PDBsum7z9y
PubMed36367089
UniProtO60885|BRD4_HUMAN Bromodomain-containing protein 4 (Gene Name=BRD4)

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