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MolNFT v1 · #164084 · protein

S-enantioselective imine reductase from mycobacterium smegmatis

6SMT: “S-enantioselective imine reductase from mycobacterium smegmatis”. X-ray diffraction, 2 ligands (NDP, 2EH). MolNFT v1 #164084 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6SMT
Type
protein
Length
1,432 residues
Chains
5
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
A0R5X0
Ligands
NDP, 2EH

Structure

x-ray diffraction · 3 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, D, E—protein286—A0R5X0
B—protein289—A0R5X0
C—protein285—A0R5X0

Ligands and binding sites

  • NDP · Nadph dihydro-nicotinamide-adenine-dinucleotide phosphate · ligand · 5 copies · chains A, B, C, D, E
  • 2EH · (2S)-2-ethylhexan-1-ol · ligand · 5 copies · chains A, B, C, D, E
  • FMT · Formic acid · additive · 12 copies · chains A, B, C, D, E
  • EDO · 1,2-ethanediol · additive · 3 copies · chains A, B, E
  • GOL · Glycerol · additive · 3 copies · chains A, B, D
  • PEG · Di(hydroxyethyl)ether · additive · chains E

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

Compared structures

  • 6SMT · S-enantioselective imine reductase from Mycobacterium smegmatis · the same entry in another collection · chain A against A, TM-score 1.00

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