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Structure of bam in MSP1E3D1 nanodiscs prepared from E. COLI outer membranes

Analyse Structure of bam in MSP1E3D1 nanodiscs prepared from E. COLI outer membranes in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7RI6
Type
protein
Length
1,520 residues
Chains
5
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Outer membrane protein assembly factor bama; Outer membrane protein assembly factor bamb…
UniProt
P0A940, A0A507WQ69, W8SZY2, C3SYV7, A0A3L5AP29
Pockets
20 · best druggability 0.83

Structure

electron microscopy · 5 distinct chains · 21% helix, 24% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AOuter membrane protein assembly factor bamaprotein78218% helix, 28% strandP0A940
BOuter membrane protein assembly factor bambprotein3700% helix, 35% strandA0A507WQ69
COuter membrane protein assembly factor bamcprotein650% helix, 0% strandW8SZY2
DOuter membrane protein assembly factor bamdprotein21776% helix, 0% strandC3SYV7
EOuter membrane protein assembly factor bameprotein8614% helix, 21% strandA0A3L5AP29

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15170.830.9084empty
27070.820.8578empty
35140.810.8754empty
41770.810.9534empty
55960.800.8550empty

Interfaces

6 interfaces between chains.

  • C–D · 1721 Ų buried · 32 hydrogen bonds · protein-protein
  • A–B · 1063 Ų buried · 14 hydrogen bonds · protein-protein
  • A–D · 1011 Ų buried · 29 hydrogen bonds · protein-protein
  • A–E · 675 Ų buried · 11 hydrogen bonds · protein-protein
  • D–E · 473 Ų buried · 3 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 7RI6 · Structure of BAM in MSP1E3D1 nanodiscs prepared from E. coli outer membranes · the same entry in another collection · chain A against A, TM-score 1.00
  • P0A940 · AlphaFold monomer V2.0 prediction for outer membrane protein assembly factor bama (P0A940) · a predicted model of the same protein · chain A against A, TM-score 0.53

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