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MolNFT v1 · #166803 · protein

Crystal structure of the bromodomain of human BRD9 bound to I-BRD9

6V1B: “Crystal structure of the bromodomain of human BRD9 bound to I-BRD9”. X-ray diffraction, 1 ligand (H1B). MolNFT v1 #166803 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6V1B
Type
protein
Length
227 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q9H8M2
Ligands
H1B

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein114—Q9H8M2
B—protein113—Q9H8M2

Ligands and binding sites

  • H1B · N'-[1,1-bis(oxidanylidene)thian-4-yl]-5-ethyl-4-oxidanylidene-7-[3-(trifluoromethyl)phenyl]thieno[3,2-c]pyridine-2-carboximidamide · ligand · 2 copies · chains A, B
  • EDO · 1,2-ethanediol · additive · chains A

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

Compared structures

  • 6V1B · Crystal structure of the bromodomain of human BRD9 bound to I-BRD9 · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9H8M2 · AlphaFold monomer V2.0 prediction for bromodomain-containing protein 9 (Q9H8M2) · a predicted model of the same protein · chain A against A, TM-score 0.92

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