GL1X · GenesisL1 explorer

MolNFT v1 · #68070 · protein

Model of the prgh-prgk periplasmic rings

3J6D · Protein prgh: “Model of the prgh-prgk periplasmic rings”. Electron microscopy, 20 pockets (best druggability 0.79). MolNFT v1 #68070 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
3J6D
Type
protein
Length
8,136 residues
Chains
48
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Protein prgh; Pathogenicity 1 island effector protein
UniProt
P41783, A0A078PCJ3
Pockets
20 · best druggability 0.79

Structure

electron microscopy · 2 distinct chains · 34% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, D, E, F, G, H, I, J, K, L, M, N, O, P, Q, R, S, T, U, V, W, XProtein prghprotein19136% helix, 18% strandP41783
a, b, c, d, e, f, g, h, i, j, k, l, m, n, o, p, q, r, s, t, u, v, Y, ZPathogenicity 1 island effector proteinprotein14832% helix, 14% strandA0A078PCJ3

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
112000.790.8085empty
25190.740.8255empty
36100.740.8164empty
46920.740.8067empty
55740.730.8150empty

Interfaces

72 interfaces between chains.

  • v–Y · 1495 Ų buried · 16 hydrogen bonds · protein-protein
  • o–p · 1494 Ų buried · 16 hydrogen bonds · protein-protein
  • l–m · 1494 Ų buried · 16 hydrogen bonds · protein-protein
  • f–g · 1494 Ų buried · 16 hydrogen bonds · protein-protein
  • n–o · 1493 Ų buried · 16 hydrogen bonds · protein-protein

Compared structures

  • 3J6D · Model of the PrgH-PrgK periplasmic rings · the same entry in another collection · chain A against A, TM-score 1.00

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