UniProt Q9WUL6
Mitogen-activated protein kinase kinase kinase 14 (Q9WUL6)
Mitogen-activated protein kinase kinase kinase 14 (UniProt Q9WUL6), EC 2.7.11.25: 20 experimental structures and 1 predicted model on GenesisL1, 8 ligands bound, 22 pockets. Binding sites, druggability and experiment against…
- UniProt
- Q9WUL6
- Protein
- Mitogen-activated protein kinase kinase kinase 14
- EC
- 2.7.11.25
- Experimental structures
- 20
- Predicted models
- 1
- Ligands
- 8
- Pockets
- 22 · 6 records with a druggable one
Structures
21 records of Q9WUL6 in the MolNFT archive: 20 experimental, 1 predicted.
| Entry | Title | Method | Chains | Ligands | Pockets |
|---|---|---|---|---|---|
| 4G3C | Crystal structure of apo murine Nf-kappaB inducing kinase (NIK) | x-ray diffraction | A, B | — | — |
| 4G3C | Crystal structure of apo murine nf-kappab inducing kinase (nik) | x-ray diffraction | A, B | — | — |
| 4G3E | Crystal structure of murine NF-kappaB inducing kinase (NIK) bound to a 6-alkynylindoline (cmp1) | x-ray diffraction | A, B | — | — |
| 4G3E | Crystal structure of murine nf-kappab inducing kinase (nik) bound to a 6-alkynylindoline (CMP1) | x-ray diffraction | A, B | — | — |
| 4G3F | Crystal structure of murine NF-kappaB inducing kinase (NIK) bound to a 2-(aminothiazoly)phenol… | x-ray diffraction | A | — | — |
| 4G3F | Crystal structure of murine nf-kappab inducing kinase (nik) bound to a 2-(AMINOTHIAZOLY)PHENOL… | x-ray diffraction | A | — | — |
| 4G3G | Crystal structure of murine NF-kappaB inducing kinase (NIK) V408L bound to a… | x-ray diffraction | A | — | — |
| 4G3G | Crystal structure of murine nf-kappab inducing kinase (nik) V408L bound to a… | x-ray diffraction | A | — | — |
| 5T8O | Crystal structure of murine nf-kappab inducing kinase (nik) bound to imidazobenzoxepin compound 3 | x-ray diffraction | A, B | SO4, 76Z | — |
| 5T8P | Crystal structure of murine NF-kappaB inducing kinase (NIK) bound to benzoxepin compound 2 | x-ray diffraction | A, B | 774, SO4 | 4 (best 0.83) |
| 5T8P | Crystal structure of murine nf-kappab inducing kinase (nik) bound to benzoxepin compound 2 | x-ray diffraction | A, B | 774, SO4 | — |
| 5T8Q | Crystal structure of murine NF-kappaB inducing kinase (NIK) bound to aryl pyrrole fragment 17 | x-ray diffraction | A, B | SO4, 76Y | 2 (best 0.82) |
| 5T8Q | Crystal structure of murine nf-kappab inducing kinase (nik) bound to aryl pyrrole fragment 17 | x-ray diffraction | A, B | SO4, 76Y | — |
| 6G4Y | Crystal structure of murine NF-kappaB inducing kinase (NIK) in complex with compound 1a | x-ray diffraction | A, B | SO4, ELZ | 2 (best 0.84) |
| 6G4Y | Crystal structure of murine nf-kappab inducing kinase (nik) in complex with compound 1A | x-ray diffraction | A, B | SO4, ELZ | — |
| 6G4Z | Crystal structure of murine NF-kappaB inducing kinase (NIK) in complex with compound 2f | x-ray diffraction | A, B | ELW | 5 (best 0.82) |
| 6G4Z | Crystal structure of murine nf-kappab inducing kinase (nik) in complex with compound 2F | x-ray diffraction | A, B | ELW | — |
| 6MYN | Crystal structure of murine NF-kappaB inducing kinase (NIK) bound to inhibitor R7 | x-ray diffraction | A, B | SO4, K6Y | 1 (best 0.87) |
| 6MYN | Crystal structure of murine nf-kappab inducing kinase (nik) bound to inhibitor R7 | x-ray diffraction | A, B | SO4, K6Y | — |
| 7SZR | NIK bound to inhibitor G02792917 | x-ray diffraction | A, B | SO4, DYQ | — |
| Q9WUL6 | AlphaFold monomer V2.0 prediction for mitogen-activated protein kinase kinase kinase 14 (Q9WUL6) | predicted | A | — | 8 (best 0.67) |
Ligands
- SO4 · Sulfate ion · in 10 records
- 76Y · 1-[(2-chlorophenyl)methyl]pyrrole-2-carboxamide · in 2 records
- 774 · 6,7-dihydrothieno[4,5]oxepino[1,2-~{c}]pyridine-2-carboxamide · in 2 records
- ELW · 5-fluoranyl-1-[4-[2-[(3~{R})-1-methyl-3-oxidanyl-2-oxidanylidene-pyrrol-3-yl]ethynyl]pyridin-2-yl]indazole-3-carboxamide · in 2 records
- ELZ · 10-[2-[(3~{R})-1-methyl-3-oxidanyl-2-oxidanylidene-pyrrolidin-3-yl]ethynyl]-~{N}3-(oxan-4-yl)-5,6-dihydroimidazo[1,2-d][1,4]benzoxazepine-2,3-dicarboxamide · in 2 records
- K6Y · (5s,7s)-9-fluoro-10-[(3R)-3-hydroxy-3-(5-methyl-1,2-oxazol-3-yl)but-1-yn-1-yl]-N~3~-methyl-6,7-dihydro-5H-5,7-methanoimidazo[2,1-a][2]benzazepine-2,3-dicarboxamide · in 2 records
- 76Z · 10-(3-methyl-3-oxidanyl-but-1-ynyl)-5,6-dihydroimidazo[1,2-d][1,4]benzoxazepine-2-carboxamide · in 1 record
- DYQ · 1-(3-{[(1R,4R,5S)-4-hydroxy-2-methyl-3-oxo-2-azabicyclo[3.1.0]hexan-4-yl]ethynyl}phenyl)-1H-pyrazolo[3,4-b]pyridine-3-carboxamide · in 1 record
Experiment against prediction
- 4G3F chain A against the predicted model Q9WUL6: TM-score 0.99, RMSD 0.90 Å
- 4G3F chain A against the predicted model Q9WUL6: TM-score 0.99, RMSD 0.90 Å
- 4G3G chain A against the predicted model Q9WUL6: TM-score 0.99, RMSD 0.92 Å
- 4G3G chain A against the predicted model Q9WUL6: TM-score 0.99, RMSD 0.92 Å
- 4G3E chain A against the predicted model Q9WUL6: TM-score 0.98, RMSD 0.94 Å
- 4G3E chain A against the predicted model Q9WUL6: TM-score 0.98, RMSD 0.94 Å
- 4G3C chain A against the predicted model Q9WUL6: TM-score 0.98, RMSD 0.94 Å
- 4G3C chain A against the predicted model Q9WUL6: TM-score 0.98, RMSD 0.94 Å
- 6G4Y chain A against the predicted model Q9WUL6: TM-score 0.98, RMSD 1.09 Å
- 6G4Y chain A against the predicted model Q9WUL6: TM-score 0.98, RMSD 1.09 Å
Elsewhere
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