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MolNFT v1 · #164133 · protein

Bamabcde in MSP1D1 nanodisc ensemble 1-4

6SOB · Outer membrane protein assembly factor bama: “Bamabcde in MSP1D1 nanodisc ensemble 1-4”. Electron microscopy, 20 pockets (best druggability 0.78). MolNFT v1 #164133 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6SOB
Type
protein
Length
1,518 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
B7MBF8, A0A2S5ZNM3, A0A4T5IPK3, P0AC04, P0A938
Pockets
20 · best druggability 0.78

Structure

electron microscopy · 5 distinct chains · 21% helix, 31% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AOuter membrane protein assembly factor bamaprotein78317% helix, 38% strandB7MBF8
BOuter membrane protein assembly factor bambprotein3710% helix, 38% strandA0A2S5ZNM3
COuter membrane protein assembly factor bamcprotein5917% helix, 0% strandA0A4T5IPK3
DOuter membrane protein assembly factor bamdprotein21875% helix, 0% strandP0AC04
EOuter membrane protein assembly factor bameprotein8715% helix, 29% strandP0A938

Pockets

20 pockets found on a 1 Å grid, 14 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16720.780.8366empty
2900.750.9722empty
3510.680.9616empty
42270.670.8430empty
54650.670.7843empty

Interfaces

6 interfaces between chains.

  • C–D · 2046 Ų buried · 39 hydrogen bonds · protein-protein
  • A–B · 1278 Ų buried · 28 hydrogen bonds · protein-protein
  • A–D · 1189 Ų buried · 39 hydrogen bonds · protein-protein
  • D–E · 726 Ų buried · 6 hydrogen bonds · protein-protein
  • A–E · 659 Ų buried · 8 hydrogen bonds · protein-protein

Compared structures

  • 6SOB · BamABCDE in MSP1D1 nanodisc ensemble 1-4 · the same entry in another collection · chain E against E, TM-score 1.00
  • P0AC04 · AlphaFold monomer V2.0 prediction for outer membrane protein assembly factor bamd (P0AC04) · a predicted model of the same protein · chain D against A, TM-score 0.96
  • P0A938 · AlphaFold monomer V2.0 prediction for outer membrane protein assembly factor bame (P0A938) · a predicted model of the same protein · chain E against A, TM-score 0.84
  • B7MBF8 · AlphaFold monomer V2.0 prediction for outer membrane protein assembly factor bama (B7MBF8) · a predicted model of the same protein · chain A against A, TM-score 0.58

Analyse

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