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Crystal structure of acrb-acrz complex

Analyse Crystal structure of acrb-acrz complex in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4CDI
Type
protein
Length
1,078 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Acriflavine resistance protein B; Predicted protein
UniProt
P31224, C4ZXT3
Pockets
12 · best druggability 0.82

Structure

x-ray diffraction · 2 distinct chains · 54% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAcriflavine resistance protein Bprotein103254% helix, 17% strandP31224
CPredicted proteinprotein4674% helix, 0% strandC4ZXT3

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19420.820.83129empty
21620.780.9439empty
32040.660.8528empty
4720.650.9327empty
52750.650.8135empty

Interfaces

1 interface between chains.

  • A–C · 1361 Ų buried · 11 hydrogen bonds · protein-protein

Compared structures

  • 4CDI · Crystal structure of AcrB-AcrZ complex · the same entry in another collection · chain A against A, TM-score 1.00
  • P31224 · AlphaFold monomer V2.0 prediction for multidrug efflux pump subunit acrb (P31224) · a predicted model of the same protein · chain A against A, TM-score 0.95

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