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MolNFT v1 · #54051 · protein

Nucleotide-bound structures of bacillus subtilis glycinamide ribonucleotide synthetase

2XD4 · Phosphoribosylamine--glycine ligase: “Nucleotide-bound structures of bacillus subtilis glycinamide ribonucleotide synthetase”. X-ray diffraction, 2 ligands (ADP, MG), 2 pockets (best druggability 0.74). MolNFT v1 #54051 on…

PDB
2XD4
Type
protein
Length
421 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Phosphoribosylamine--glycine ligase
EC
6.3.4.13
UniProt
P12039
Ligands
ADP, MG
Pockets
2 · best druggability 0.74

Structure

x-ray diffraction · 1 distinct chain · 32% helix, 29% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APhosphoribosylamine--glycine ligase (EC 6.3.4.13)protein42132% helix, 29% strandP12039

Ligands and binding sites

  • ADP · Adenosine-5'-diphosphate · ligand · chains A
  • MG · Magnesium ion · metal · 3 copies · 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
18920.740.7889MG, ADP
21030.340.7318empty

Compared structures

  • 2XD4 · Nucleotide-bound Structures of Bacillus subtilis Glycinamide Ribonucleotide Synthetase · the same entry in another collection · chain A against A, TM-score 1.00
  • P12039 · AlphaFold monomer V2.0 prediction for phosphoribosylamine--glycine ligase (P12039) · a predicted model of the same protein · chain A against A, TM-score 0.98

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