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New crystal form of pseudomonas glumae (formerly chromobacterium viscosum atcc 6918) lipase

Analyse New crystal form of pseudomonas glumae (formerly chromobacterium viscosum atcc… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1QGE
Type
protein
Length
316 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Protein (triacylglycerol hydrolase)
EC
3.1.1.3
UniProt
Q05489
Ligands
CA
Pockets
1 · best druggability 0.40

Structure

x-ray diffraction · 2 distinct chains · 39% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
DProtein (triacylglycerol hydrolase) (EC 3.1.1.3)protein21938% helix, 17% strandQ05489
EProtein (triacylglycerol hydrolase) (EC 3.1.1.3)protein9740% helix, 12% strandQ05489

Ligands and binding sites

  • CA · Calcium ion · metal · chains E

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

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1610.400.8019empty

Interfaces

1 interface between chains.

  • D–E · 3036 Ų buried · 57 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 1QGE · New crystal form of pseudomonas glumae (formerly chromobacterium viscosum atcc 6918)… · the same entry in another collection · chain D against D, TM-score 1.00

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