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MolNFT v1 · #164812 · protein

Oprm-mexa complex from the mexab-oprm pseudomonas aeruginosa whole assembly reconstituted in nanodiscs

6TA5 · Outer membrane protein oprm: “Oprm-mexa complex from the mexab-oprm pseudomonas aeruginosa whole assembly reconstituted in nanodiscs”. Electron microscopy, 20 pockets (best druggability 0.88). MolNFT v1 #164812 on GenesisL1: 3D…

PDB
6TA5
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 0.88

Structure

electron microscopy · 4 distinct chains · 39% helix, 22% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, COuter membrane protein oprmprotein45560% helix, 11% strandQ51487
D, F, HMexa family multidrug efflux rnd transporter periplasmic adaptor subunitprotein34519% helix, 34% strandA0A2V3GTR8
E, G, IMexa family multidrug efflux rnd transporter periplasmic adaptor subunitprotein34318% helix, 34% strandA0A2V3GTR8
J, K, LEfflux pump membrane transporterprotein103042% helix, 18% strandA0A069Q9M6

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18710.880.9084empty
26500.870.9273empty
34630.860.9374empty
45090.840.9071empty
510610.830.84112empty

Interfaces

33 interfaces between chains.

  • J–L · 3556 Ų buried · 31 hydrogen bonds · protein-protein
  • K–L · 3416 Ų buried · 35 hydrogen bonds · protein-protein
  • J–K · 3182 Ų buried · 25 hydrogen bonds · protein-protein
  • B–C · 2689 Ų buried · 34 hydrogen bonds · protein-protein
  • A–B · 2666 Ų buried · 36 hydrogen bonds · protein-protein

Compared structures

  • 6TA5 · OprM-MexA complex from the MexAB-OprM Pseudomonas aeruginosa whole assembly reconstituted… · the same entry in another collection · chain L against L, TM-score 1.00

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