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MolNFT v1 · #41025 · protein

Universal stress protein RV2623 from mycobaterium tuberculosis

2JAX · Hypothetical protein TB31.7: “Universal stress protein RV2623 from mycobaterium tuberculosis”. X-ray diffraction, 2 ligands (ATP, UNX), 3 pockets (best druggability 0.66). MolNFT v1 #41025 on GenesisL1: 3D structure, binding sites…

PDB
2JAX
Type
protein
Length
261 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Hypothetical protein TB31.7
UniProt
O06189
Ligands
ATP, UNX
Pockets
3 · best druggability 0.66

Structure

x-ray diffraction · 1 distinct chain · 39% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHypothetical protein TB31.7protein26139% helix, 16% strandO06189

Ligands and binding sites

  • ATP · Adenosine-5'-triphosphate · ligand · 2 copies · chains A
  • UNX · Unknown atom or ion · ion · 2 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11420.660.8824ATP, UNX
21880.560.8033ATP, UNX
31140.380.7418empty

Modifications

Observed in the structure: 4 modified, 1 covalent (engineered, covalent ligand).

Compared structures

  • 2JAX · Universal Stress Protein Rv2623 from Mycobaterium Tuberculosis · the same entry in another collection · chain A against A, TM-score 1.00

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