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MolNFT v1 · #85766 · protein

Crystal structure of the glycosyltransferase snogd from streptomyces nogalater

4AMB: “Crystal structure of the glycosyltransferase snogd from streptomyces nogalater”. X-ray diffraction, 1 ligand (DUD), 9 pockets (best druggability 0.77). MolNFT v1 #85766 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
4AMB
Type
protein
Length
743 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Snogd
UniProt
Q9RN61
Ligands
DUD
Pockets
9 · best druggability 0.77

Structure

x-ray diffraction · 2 distinct chains · 43% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASnogdprotein37043% helix, 15% strandQ9RN61
BSnogdprotein37343% helix, 15% strandQ9RN61

Ligands and binding sites

  • DUD · Deoxyuridine-5'-diphosphate · ligand · chains B

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

Pockets

9 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13410.770.8850empty
27040.720.7965DUD
33010.720.8543empty
45990.710.7962empty
5660.540.8825empty

Interfaces

1 interface between chains.

  • A–B · 1492 Ų buried · 24 hydrogen bonds · protein-protein

Compared structures

  • 4AMB · Crystal structure of the glycosyltransferase SnogD from Streptomyces nogalater · the same entry in another collection · chain A against A, TM-score 1.00

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