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MolNFT v1 · #52333 · protein

Screening a limited structure-based library identifies udp- galnac-specific mutants of alpha-1,3 galactosyltransferase

2VXL · N-acetyllactosaminide alpha-1,3-galactosyltransferase: “Screening a limited structure-based library identifies udp- galnac-specific mutants of alpha-1,3…”. X-ray diffraction, 2 ligands (UDP, MN), 2 pockets (best druggability 0.62).…

PDB
2VXL
Type
protein
Length
277 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
N-acetyllactosaminide alpha-1,3-galactosyltransferase
EC
2.4.1.87
UniProt
P14769
Ligands
UDP, MN
Pockets
2 · best druggability 0.62

Structure

x-ray diffraction · 1 distinct chain · 35% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AN-acetyllactosaminide alpha-1,3-galactosyltransferase (EC 2.4.1.87)protein27735% helix, 21% strandP14769

Ligands and binding sites

  • UDP · Uridine-5'-diphosphate · ligand · chains A
  • MN · Manganese (II) 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
12990.620.7931UDP
2770.320.7414empty

Compared structures

  • 2VXL · Screening a Limited Structure-based Library Identifies UDP-GalNAc- Specific Mutants of… · the same entry in another collection · chain A against A, TM-score 1.00
  • P14769 · AlphaFold monomer V2.0 prediction for N-acetyllactosaminide… · a predicted model of the same protein · chain A against A, TM-score 1.00

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