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Crystal structure of acanthamoeba polyphaga mimivirus ndk, the first viral nucleoside diphosphate kinase

Analyse Crystal structure of acanthamoeba polyphaga mimivirus ndk, the first viral… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2B8P
Type
protein
Length
259 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Probable nucleoside diphosphate kinase
EC
2.7.4.6
UniProt
Q5UQL3
Ligands
SO4
Pockets
2 · best druggability 0.49

Structure

x-ray diffraction · 2 distinct chains · 44% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AProbable nucleoside diphosphate kinase (EC 2.7.4.6)protein12944% helix, 20% strandQ5UQL3
BProbable nucleoside diphosphate kinase (EC 2.7.4.6)protein13045% helix, 22% strandQ5UQL3

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 4 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11820.490.7727SO4
2590.270.7316SO4

Interfaces

1 interface between chains.

  • A–B · 777 Ų buried · 8 hydrogen bonds · protein-protein

Compared structures

  • 2B8P · Crystal structure of Acanthamoeba polyphaga mimivirus NDK, the first viral nucleoside… · the same entry in another collection · chain A against A, TM-score 1.00

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