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MolNFT v1 · #49489 · protein

Crystal structure of putative metal-dependent hydrolase (YP_805737.1) from lactobacillus casei atcc 334 at 1.40 a resolution

2QPX · Predicted metal-dependent hydrolase of the tim-barrel fold: “Crystal structure of putative metal-dependent hydrolase (YP_805737.1) from lactobacillus casei atcc 334 at…”. X-ray diffraction, 1 ligand (ZN), 1 pocket (best druggability…

PDB
2QPX
Type
protein
Length
376 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Predicted metal-dependent hydrolase of the tim-barrel fold
UniProt
Q03BX7
Ligands
ZN
Pockets
1 · best druggability 0.61

Structure

x-ray diffraction · 1 distinct chain · 53% helix, 11% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APredicted metal-dependent hydrolase of the tim-barrel foldprotein37653% helix, 11% strandQ03BX7

Ligands and binding sites

  • ZN · Zinc ion · metal · 2 copies · chains A
  • EDO · 1,2-ethanediol · additive · 11 copies · 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
13500.610.7833empty

Modifications

Observed in the structure: 9 modified (engineered, carboxylation).

Compared structures

  • 2QPX · Crystal structure of putative metal-dependent hydrolase (YP_805737.1) from Lactobacillus… · the same entry in another collection · chain A against A, TM-score 1.00

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