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MolNFT v1 · #169987 · protein

Eqadh-NADH-heptafluorobutanol, P21

6XT2: “Eqadh-NADH-heptafluorobutanol, P21”. X-ray diffraction, 3 ligands (NAI, B7F, ZN). MolNFT v1 #169987 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6XT2
Type
protein
Length
1,496 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
P00327
Ligands
NAI, B7F, ZN

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, D—protein374—P00327

Ligands and binding sites

  • NAI · 1,4-dihydronicotinamide adenine dinucleotide · ligand · 4 copies · chains A, B, C, D
  • B7F · 2,2,3,3,4,4,4-heptafluorobutan-1-ol · ligand · 4 copies · chains A, B, C, D
  • ZN · Zinc ion · metal · 8 copies · chains A, B, C, D
  • MRD · (4R)-2-methylpentane-2,4-diol · additive · 2 copies · chains B, C

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

Compared structures

  • 6XT2 · Eqadh-NADH-heptafluorobutanol, P21 · the same entry in another collection · chain D against D, TM-score 1.00
  • P00327 · AlphaFold monomer V2.0 prediction for alcohol dehydrogenase E chain (P00327) · a predicted model of the same protein · chain C against A, TM-score 1.00

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