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MolNFT v1 · #122159 · protein

Macrolide 2'-phosphotransferase type II - complex with GDP and clarithromycin

5IGW · Macrolide 2'-phosphotransferase II: “Macrolide 2'-phosphotransferase type II - complex with GDP and clarithromycin”. X-ray diffraction, 3 ligands (GDP, CTY, MG), 1 pocket (best druggability 0.74). MolNFT v1 #122159 on GenesisL1: 3D…

PDB
5IGW
Type
protein
Length
296 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Macrolide 2'-phosphotransferase II
UniProt
O32553
Ligands
GDP, CTY, MG
Pockets
1 · best druggability 0.74

Structure

x-ray diffraction · 1 distinct chain · 47% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMacrolide 2'-phosphotransferase IIprotein29647% helix, 16% strandO32553

Ligands and binding sites

  • GDP · Guanosine-5'-diphosphate · ligand · chains A
  • CTY · Clarithromycin · ligand · chains A
  • MG · Magnesium ion · metal · 2 copies · chains A

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

Pockets

1 pocket found on a 1 Å grid, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19310.740.7775GDP, MG, CTY

Compared structures

  • 5IGW · Macrolide 2'-phosphotransferase type II - complex with GDP and clarithromycin · the same entry in another collection · chain A against A, TM-score 1.00

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