Structure of PDB 6u61 Chain A Binding Site BS02

Receptor Information
>6u61 Chain A (length=118) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
KKPGRVTNQLQYLHKVVMKALWKHQFAWPFRQPVDAVKLGLPDYHKIIKQ
PMDMGTIKRRLENNYYWAASECMQDFNTMFTNCYIYNKPTDDIVLMAQTL
EKIFLQKVASMPQEEQEL
Ligand information
Ligand IDZN
InChIInChI=1S/Zn/q+2
InChIKeyPTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Zn+2]
FormulaZn
NameZINC ION
ChEMBLCHEMBL1236970
DrugBankDB14532
ZINC
PDB chain6u61 Chain A Residue 201 [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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PDB6u61 Cyclic peptides can engage a single binding pocket through highly divergent modes.
Resolution2.29 Å
Binding residue
(original residue number in PDB)		H83 E131
Binding residue
(residue number reindexed from 1)		H14 E62
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:6u61, PDBe:6u61, PDBj:6u61
PDBsum6u61
PubMed33046654
UniProtP25440|BRD2_HUMAN Bromodomain-containing protein 2 (Gene Name=BRD2)

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