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Crystal structure of xanthomonas campestri olea

Analyse Crystal structure of xanthomonas campestri olea in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3ROW
Type
protein
Length
670 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
3-oxoacyl-[acp] synthase III
EC
2.3.1.41
UniProt
Q8PDX2
Pockets
6 · best druggability 0.75

Structure

x-ray diffraction · 2 distinct chains · 45% helix, 24% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A3-oxoacyl-[acp] synthase III (EC 2.3.1.41)protein34445% helix, 25% strandQ8PDX2
B3-oxoacyl-[acp] synthase III (EC 2.3.1.41)protein32645% helix, 24% strandQ8PDX2

Pockets

6 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13740.750.8563empty
2510.670.9617empty
36140.660.7666empty
41920.570.8129empty
51850.550.8026empty

Interfaces

1 interface between chains.

  • A–B · 2262 Ų buried · 43 hydrogen bonds · protein-protein

Compared structures

  • 3ROW · Crystal Structure of Xanthomonas campestri OleA · the same entry in another collection · chain A against A, TM-score 1.00
  • Q8PDX2 · AlphaFold monomer V2.0 prediction for acyl-COA:ACYL-CoA alkyltransferase (Q8PDX2) · a predicted model of the same protein · chain B against A, TM-score 0.99

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