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2-desoxiribosyltransferase from leishmania mexicana

Analyse 2-desoxiribosyltransferase from leishmania mexicana in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6QAI
Type
protein
Length
305 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
2-deoxyribosyltransferase
UniProt
E9AWJ0
Pockets
2 · best druggability 0.36

Structure

x-ray diffraction · 2 distinct chains · 40% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A2-deoxyribosyltransferaseprotein15541% helix, 16% strandE9AWJ0
B2-deoxyribosyltransferaseprotein15040% helix, 17% strandE9AWJ0

Ligands and binding sites

  • TRS · 2-amino-2-hydroxymethyl-propane-1,3-diol · additive · 3 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11020.360.7523empty
2770.360.7613empty

Interfaces

1 interface between chains.

  • A–B · 1914 Ų buried · 15 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 covalent (additive adduct).

Compared structures

  • 6QAI · 2-desoxiribosyltransferase from Leishmania mexicana · the same entry in another collection · chain A against A, TM-score 1.00

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