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MolNFT v1 · #134590 · protein

Crystal structure of murine nf-kappab inducing kinase (nik) bound to aryl pyrrole fragment 17

5T8Q: “Crystal structure of murine nf-kappab inducing kinase (nik) bound to aryl pyrrole fragment 17”. X-ray diffraction, 2 ligands (76Y, SO4). MolNFT v1 #134590 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5T8Q
Type
protein
Length
651 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q9WUL6
Ligands
76Y, SO4

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein323—Q9WUL6
B—protein328—Q9WUL6

Ligands and binding sites

  • 76Y · 1-[(2-chlorophenyl)methyl]pyrrole-2-carboxamide · ligand · 2 copies · chains A, B
  • SO4 · Sulfate ion · ion · 11 copies · chains A, B

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

Compared structures

  • 5T8Q · Crystal structure of murine NF-kappaB inducing kinase (NIK) bound to aryl pyrrole… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9WUL6 · AlphaFold monomer V2.0 prediction for mitogen-activated protein kinase kinase kinase 14… · a predicted model of the same protein · chain A against A, TM-score 0.98

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