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Crystal structures of zinc containing adenylate kinase from desulfovibrio gigas

Analyse Crystal structures of zinc containing adenylate kinase from desulfovibrio gigas in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2XB4
Type
protein
Length
223 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Adenylate kinase
EC
2.7.4.3
UniProt
C7U112
Ligands
SRT, ZN
Pockets
3 · best druggability 0.48

Structure

x-ray diffraction · 1 distinct chain · 50% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAdenylate kinase (EC 2.7.4.3)protein22350% helix, 15% strandC7U112

Ligands and binding sites

  • SRT · S,R meso-tartaric acid · ligand · chains A
  • ZN · Zinc ion · metal · chains A

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

Pockets

3 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11930.480.7628empty
2910.480.8116empty
3500.270.7412empty

Compared structures

  • 2XB4 · Crystal structures of zinc containing Adenylate kinase from Desulfovibrio gigas · the same entry in another collection · chain A against A, TM-score 1.00

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