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MolNFT v1 · #180766 · protein

Crystal structure of the first bromodomain (BD1) of human BRD2 bound to RO3280

7LAJ: “Crystal structure of the first bromodomain (BD1) of human BRD2 bound to RO3280”. X-ray diffraction, 1 ligand (79C). MolNFT v1 #180766 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7LAJ
Type
protein
Length
122 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
U3KQA6
Ligands
79C

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein122—U3KQA6

Ligands and binding sites

  • 79C · 4-[(9-cyclopentyl-7,7-difluoro-5-methyl-6-oxo-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b][1,4]diazepin-2-yl) amino]-3-methoxy-N-(1-methylpiperidin-4-yl)benzamide · ligand · chains A

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Compared structures

  • 7LAJ · Crystal structure of the first bromodomain (BD1) of human BRD2 bound to Ro3280 · the same entry in another collection · chain A against A, TM-score 1.00

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