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MolNFT v1 · #10536 · protein

The structure of TT1380 protein from thermus thermophilus

1IUJ · Hypothetical protein TT1380: “The structure of TT1380 protein from thermus thermophilus”. X-ray diffraction, 1 ligand (ZN), 2 pockets (best druggability 0.61). MolNFT v1 #10536 on GenesisL1: 3D structure, binding sites and pockets…

PDB
1IUJ
Type
protein
Length
205 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Hypothetical protein TT1380
UniProt
P83693
Ligands
ZN
Pockets
2 · best druggability 0.61

Structure

x-ray diffraction · 2 distinct chains · 33% helix, 34% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHypothetical protein TT1380protein10231% helix, 34% strandP83693
BHypothetical protein TT1380protein10334% helix, 34% strandP83693

Ligands and binding sites

  • ZN · Zinc ion · metal · 7 copies · chains A, 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, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1820.610.8929ZN
21580.590.8331ZN

Interfaces

1 interface between chains.

  • A–B · 1628 Ų buried · 29 hydrogen bonds · protein-protein

Compared structures

  • 1IUJ · The structure of TT1380 protein from thermus thermophilus · the same entry in another collection · chain A against A, TM-score 1.00

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