GL1X · GenesisL1 explorer

MolNFT v1 · #11369 · protein

Brefeldin a esterase, a bacterial homologue of human hormone sensitive lipase

1JKM: “Brefeldin a esterase, a bacterial homologue of human hormone sensitive lipase”. X-ray diffraction, 10 pockets (best druggability 0.71). MolNFT v1 #11369 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
1JKM
Type
protein
Length
719 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Brefeldin a esterase
Pockets
10 · best druggability 0.71

Structure

x-ray diffraction · 2 distinct chains · 42% helix, 18% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ABrefeldin a esteraseprotein35842% helix, 17% strand—
BBrefeldin a esteraseprotein36142% helix, 18% strand—

Pockets

10 pockets found on a 1 Å grid, 6 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15020.710.8168empty
26240.710.7849empty
32440.700.8535empty
42480.700.8535empty
51380.670.8930empty

Interfaces

1 interface between chains.

  • A–B · 1485 Ų buried · 23 hydrogen bonds · protein-protein

Compared structures

  • 1JKM · Brefeldin a esterase, a bacterial homologue of human hormone sensitive lipase · the same entry in another collection · chain A against A, TM-score 1.00

Analyse

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