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Mexab assembly of the pseudomonas mexab-oprm efflux pump reconstituted in nanodiscs

Analyse Mexab assembly of the pseudomonas mexab-oprm efflux pump reconstituted in… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6TA6
Type
protein
Length
6,519 residues
Chains
12
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Outer membrane protein oprm; Mexa family multidrug efflux rnd transporter periplasmic…
UniProt
Q51487, A0A2V3GTR8, A0A069Q9M6
Pockets
20 · best druggability 0.89

Structure

electron microscopy · 4 distinct chains · 42% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, COuter membrane protein oprmprotein45560% helix, 10% strandQ51487
D, F, HMexa family multidrug efflux rnd transporter periplasmic adaptor subunitprotein34521% helix, 34% strandA0A2V3GTR8
E, G, IMexa family multidrug efflux rnd transporter periplasmic adaptor subunitprotein34320% helix, 31% strandA0A2V3GTR8
J, K, LEfflux pump membrane transporterprotein103048% helix, 19% strandA0A069Q9M6

Pockets

20 pockets found on a 1 Å grid, 20 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111170.890.91168empty
211240.890.91121empty
36680.860.9187empty
45610.850.9065empty
56070.820.8771empty

Interfaces

33 interfaces between chains.

  • J–L · 3495 Ų buried · 30 hydrogen bonds · protein-protein
  • K–L · 3321 Ų buried · 36 hydrogen bonds · protein-protein
  • J–K · 3131 Ų buried · 23 hydrogen bonds · protein-protein
  • A–B · 2602 Ų buried · 31 hydrogen bonds · protein-protein
  • B–C · 2601 Ų buried · 33 hydrogen bonds · protein-protein

Compared structures

  • 6TA6 · MexAB assembly of the Pseudomonas MexAB-OprM efflux pump reconstituted in nanodiscs · the same entry in another collection · chain L against L, TM-score 1.00

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