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Crystal structure of the human vaccinia-related kinase bound to a N,N- dipropyl-dihydropteridine inhibitor

Analyse Crystal structure of the human vaccinia-related kinase bound to a N,N… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6DD4
Type
protein
Length
1,254 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q99986
Ligands
G6J, CL, SO4

Structure

x-ray diffraction · 4 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein317—Q99986
B—protein309—Q99986
C—protein317—Q99986
D—protein311—Q99986

Ligands and binding sites

  • G6J · (7R)-2-[(3,5-difluoro-4-hydroxyphenyl)amino]-7-methyl-5,8-dipropyl-7,8-dihydropteridin-6(5H)-one · ligand · 2 copies · chains B, D
  • CL · Chloride ion · ion · 8 copies · chains A, D
  • SO4 · Sulfate ion · ion · 6 copies · chains B, C, D
  • ACT · Acetate ion · additive · 7 copies · chains A, B, C, D
  • GOL · Glycerol · additive · 2 copies · chains B, C

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

Compared structures

  • 6DD4 · Crystal Structure of the Human vaccinia-related kinase bound to a… · the same entry in another collection · chain A against A, TM-score 1.00

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