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MolNFT v1 · #109585 · protein

Crystal structure of lipase from geobacillus stearothermophilus T6 methanol stable variant A269T

4X71: “Crystal structure of lipase from geobacillus stearothermophilus T6 methanol stable variant A269T”. X-ray diffraction, 2 ligands (ZN, CA), 3 pockets (best druggability 0.53). MolNFT v1 #109585 on GenesisL1: 3D structure, binding…

PDB
4X71
Type
protein
Length
392 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Lipase
EC
3.1.1.3
UniProt
Q93A71
Ligands
ZN, CA
Pockets
3 · best druggability 0.53

Structure

x-ray diffraction · 1 distinct chain · 36% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ALipase (EC 3.1.1.3)protein39236% helix, 15% strandQ93A71

Ligands and binding sites

  • ZN · Zinc ion · metal · chains A
  • CA · Calcium ion · metal · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11770.530.7924empty
2540.340.7818empty
3500.270.7416empty

Compared structures

  • 4X71 · Crystal Structure of lipase from Geobacillus stearothermophilus T6 methanol stable… · the same entry in another collection · chain A against A, TM-score 1.00

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