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MolNFT v1 · #86056 · protein

Single particle electron microscopy of pilq dodecameric complexes from neisseria meningitidis.

4AV2 · Type IV pilus biogenesis and competence protein pilq: “Single particle electron microscopy of pilq dodecameric complexes from neisseria meningitidis.”. Electron microscopy, 20 pockets (best druggability 0.82). MolNFT v1 #86056 on…

PDB
4AV2
Type
protein
Length
4,272 residues
Chains
24
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Type IV pilus biogenesis and competence protein pilq; Pilp protein
UniProt
Q70M91, Q7DD77
Pockets
20 · best druggability 0.82

Structure

electron microscopy · 2 distinct chains · 21% helix, 38% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, D, E, F, G, H, I, J, K, LType IV pilus biogenesis and competence protein pilqprotein27426% helix, 33% strandQ70M91
M, N, O, P, Q, R, S, T, U, V, W, XPilp proteinprotein825% helix, 56% strandQ7DD77

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110860.820.83114empty
28690.800.8389empty
310530.800.82108empty
45800.760.8265empty
55720.750.8256empty

Interfaces

24 interfaces between chains.

  • J–K · 1824 Ų buried · 25 hydrogen bonds · protein-protein
  • K–L · 1824 Ų buried · 26 hydrogen bonds · protein-protein
  • C–D · 1823 Ų buried · 25 hydrogen bonds · protein-protein
  • B–C · 1823 Ų buried · 25 hydrogen bonds · protein-protein
  • A–B · 1823 Ų buried · 25 hydrogen bonds · protein-protein

Compared structures

  • 4AV2 · Single particle electron microscopy of PilQ dodecameric complexes from Neisseria… · the same entry in another collection · chain A against A, TM-score 1.00

Analyse

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