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Crystal structure of trypanosoma brucei gambiense glycerol kinase (ligand-free form)

Analyse Crystal structure of trypanosoma brucei gambiense glycerol kinase (ligand-free… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3WXI
Type
protein
Length
1,025 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Glycerol kinase
EC
2.7.1.30
UniProt
D3KVM3
Pockets
7 · best druggability 0.63

Structure

x-ray diffraction · 2 distinct chains · 37% helix, 22% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGlycerol kinase (EC 2.7.1.30)protein51337% helix, 23% strandD3KVM3
BGlycerol kinase (EC 2.7.1.30)protein51237% helix, 22% strandD3KVM3

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14470.630.7747empty
22510.610.8030empty
32330.580.8032empty
41590.490.7728empty
5930.370.7519empty

Interfaces

1 interface between chains.

  • A–B · 1436 Ų buried · 24 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

  • 3WXI · Crystal structure of trypanosoma brucei gambiense glycerol kinase (ligand-free form) · the same entry in another collection · chain A against A, TM-score 1.00

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