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Crystal structure of pyrano 1,3, oxazine derivative in complex with the second bromodomain of BRD2

Analyse Crystal structure of pyrano 1,3, oxazine derivative in complex with the second… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7EO5
Type
protein
Length
115 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
P25440
Ligands
BUX

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein115—P25440

Ligands and binding sites

  • BUX · 7-chloranyl-2-[(3-chlorophenyl)amino]pyrano[3,4-E][1, 3]oxazine-4,5-dione · ligand · chains A
  • PGE · Triethylene glycol · additive · chains A

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

Compared structures

  • 7EO5 · Crystal structure of pyrano 1,3, oxazine derivative in complex with the second… · the same entry in another collection · chain A against A, TM-score 1.00
  • P25440 · AlphaFold monomer V2.0 prediction for bromodomain-containing protein 2 (P25440) · a predicted model of the same protein · chain A against A, TM-score 0.94

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