GL1X · GenesisL1 explorer

MolNFT v1 · #149702 · protein

Crystal structure of M. tuberculosis DPRE1 in complex with SPBTZ169 (sulfonylpbtz)

6G83: “Crystal structure of M. tuberculosis DPRE1 in complex with SPBTZ169 (sulfonylpbtz)”. X-ray diffraction, 2 ligands (FAD, EQ8). MolNFT v1 #149702 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6G83
Type
protein
Length
837 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
P9WJF0
Ligands
FAD, EQ8

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein425—P9WJF0
B—protein412—P9WJF0

Ligands and binding sites

  • FAD · Flavin-adenine dinucleotide · ligand · 2 copies · chains A, B
  • EQ8 · [2-(4-cyclohexylsulfonylpiperazin-1-yl)-4-oxidanylidene-6-(trifluoromethyl)-1,3-benzothiazin-8-yl]-oxidanylidene-azanium · ligand · 2 copies · chains A, B

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

Compared structures

  • 6G83 · Crystal structure of M. tuberculosis DprE1 in complex with sPBTZ169 (sulfonylPBTZ) · the same entry in another collection · chain A against A, TM-score 1.00
  • P9WJF0 · AlphaFold monomer V2.0 prediction for decaprenylphosphoryl-beta-D- ribose oxidase (P9WJF0) · a predicted model of the same protein · chain B against A, TM-score 0.98

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