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MolNFT v1 · #103320 · protein

Crystal structure of vccnt-7C8C bound to uridine

4PD6 · Nupc family protein: “Crystal structure of vccnt-7C8C bound to uridine”. X-ray diffraction, 2 ligands (URI, NA), 6 pockets (best druggability 0.65). MolNFT v1 #103320 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
4PD6
Type
protein
Length
401 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Nupc family protein
UniProt
Q9KPL5
Ligands
URI, NA
Pockets
6 · best druggability 0.65

Structure

x-ray diffraction · 1 distinct chain · 78% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ANupc family proteinprotein40178% helix, 0% strandQ9KPL5

Ligands and binding sites

  • URI · Uridine · ligand · chains A
  • NA · Sodium ion · metal · chains A
  • DMU · Decyl-beta-D-maltopyranoside · additive · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13700.650.7938URI
21720.620.8320empty
31030.410.7618empty
4760.350.7518empty
5540.310.7618empty

Compared structures

  • 4PD6 · Crystal structure of vcCNT-7C8C bound to uridine · the same entry in another collection · chain A against A, TM-score 1.00

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