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MolNFT v1 · #135226 · protein

Crystal structure of iunh from leishmania braziliensis in complex with D-ribose

5TSQ: “Crystal structure of iunh from leishmania braziliensis in complex with D-ribose”. X-ray diffraction, 2 ligands (BDR, CA), 2 pockets (best druggability 0.62). MolNFT v1 #135226 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
5TSQ
Type
protein
Length
312 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Iunh
EC
3.2.2.1
UniProt
A4H9Q9
Ligands
BDR, CA
Pockets
2 · best druggability 0.62

Structure

x-ray diffraction · 1 distinct chain · 42% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AIunh (EC 3.2.2.1)protein31242% helix, 17% strandA4H9Q9

Ligands and binding sites

  • BDR · beta-D-ribofuranose · ligand · chains A
  • CA · Calcium ion · metal · chains A

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
1950.620.8925BDR
2500.270.7414empty

Compared structures

  • 5TSQ · Crystal structure of IUnH from Leishmania braziliensis in complex with D-Ribose · the same entry in another collection · chain A against A, TM-score 1.00

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