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MolNFT v1 · #119642 · protein

Type IV-like competence pilin TTHA1222 from thermus thermophilus

5G2F · Type-IV like pilin TTHA1222: “Type IV-like competence pilin TTHA1222 from thermus thermophilus”. X-ray diffraction, 1 ligand (SO4), 2 pockets (best druggability 0.71). MolNFT v1 #119642 on GenesisL1: 3D structure, binding sites and…

PDB
5G2F
Type
protein
Length
246 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Type-IV like pilin TTHA1222
UniProt
Q5SIZ2
Ligands
SO4
Pockets
2 · best druggability 0.71

Structure

x-ray diffraction · 2 distinct chains · 20% helix, 26% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BType-IV like pilin TTHA1222protein8620% helix, 27% strandQ5SIZ2
CType-IV like pilin TTHA1222protein7420% helix, 26% strandQ5SIZ2

Ligands and binding sites

  • SO4 · Sulfate ion · ion · chains B

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14610.710.8154empty
2970.340.7416empty

Interfaces

3 interfaces between chains.

  • A–B · 621 Ų buried · 9 hydrogen bonds · protein-protein
  • B–C · 399 Ų buried · 0 hydrogen bonds · protein-protein
  • A–C · 111 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 3 disulfide (disulfide).

Compared structures

  • 5G2F · Type IV-like competence pilin TTHA1222 from Thermus thermophilus · the same entry in another collection · chain A against A, TM-score 1.00

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