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MolNFT v1 · #52927 · protein

Structure of the candida albicans cytosolic leucyl-tRNA synthetase editing domain

2WFE: “Structure of the candida albicans cytosolic leucyl-tRNA synthetase editing domain”. X-ray diffraction, 14 pockets (best druggability 0.70). MolNFT v1 #52927 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
2WFE
Type
protein
Length
983 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cytosolic leucyl-tRNA synthetase
UniProt
Q5A9A4
Pockets
14 · best druggability 0.70

Structure

x-ray diffraction · 4 distinct chains · 34% helix, 25% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACytosolic leucyl-tRNA synthetaseprotein24634% helix, 25% strandQ5A9A4
BCytosolic leucyl-tRNA synthetaseprotein25035% helix, 24% strandQ5A9A4
CCytosolic leucyl-tRNA synthetaseprotein24633% helix, 26% strandQ5A9A4
DCytosolic leucyl-tRNA synthetaseprotein24134% helix, 26% strandQ5A9A4

Pockets

14 pockets found on a 1 Å grid, 8 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13680.700.8243empty
23310.690.8335empty
32810.690.8427empty
43310.670.8126empty
54870.650.7739empty

Interfaces

4 interfaces between chains.

  • C–D · 740 Ų buried · 11 hydrogen bonds · protein-protein
  • B–C · 502 Ų buried · 2 hydrogen bonds · protein-protein
  • A–B · 273 Ų buried · 5 hydrogen bonds · protein-protein
  • A–C · 90 Ų buried · 1 hydrogen bond · protein-protein

Compared structures

  • 2WFE · Structure of the Candida albicans cytosolic leucyl-tRNA synthetase editing domain · the same entry in another collection · chain A against A, TM-score 1.00

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