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MolNFT v1 · #140149 · protein

Monomeric L-threonine 3-dehydrogenase from metagenome database (akb and NADH bound form)

5Y1G · NAD dependent EPIMERASE/DEHYDRATASE family: “Monomeric L-threonine 3-dehydrogenase from metagenome database (akb and NADH bound form)”. X-ray diffraction, 2 ligands (AKB, NAD), 1 pocket (best druggability 0.76). MolNFT v1 #140149 on…

PDB
5Y1G
Type
protein
Length
310 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
NAD dependent EPIMERASE/DEHYDRATASE family
UniProt
D6PBM7
Ligands
AKB, NAD
Pockets
1 · best druggability 0.76

Structure

x-ray diffraction · 1 distinct chain · 45% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ANAD dependent EPIMERASE/DEHYDRATASE familyprotein31045% helix, 16% strandD6PBM7

Ligands and binding sites

  • AKB · 2-amino-3-ketobutyric acid · ligand · chains A
  • NAD · Nicotinamide-adenine-dinucleotide · ligand · chains A

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

Pockets

1 pocket found on a 1 Å grid, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13920.760.8646AKB, NAD

Compared structures

  • 5Y1G · Monomeric L-threonine 3-dehydrogenase from metagenome database (AKB and NADH bound form) · the same entry in another collection · chain A against A, TM-score 1.00

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