UniProt O14874
[3-methyl-2-oxobutanoate dehydrogenase [lipoamide]] kinase, mitochondrial (O14874)
[3-methyl-2-oxobutanoate dehydrogenase [lipoamide]] kinase, mitochondrial (UniProt O14874), EC 2.7.11.1, 2.7.11.4: 4 experimental structures and 1 predicted model on GenesisL1, 9 ligands bound, 37 pockets. Binding sites…
- UniProt
- O14874
- Protein
- [3-methyl-2-oxobutanoate dehydrogenase [lipoamide]] kinase, mitochondrial
- EC
- 2.7.11.1, 2.7.11.4
- Experimental structures
- 4
- Predicted models
- 1
- Ligands
- 9
- Pockets
- 37 · 4 records with a druggable one
Structures
5 records of O14874 in the MolNFT archive: 4 experimental, 1 predicted.
| Entry | Title | Method | Chains | Ligands | Pockets |
|---|---|---|---|---|---|
| 8F5F | human branched chain ketoacid dehydrogenase kinase in complex with inhibitors | x-ray diffraction | A, B | ADP, MG, XGG, SO4 | 14 (best 0.78) |
| 8F5J | human branched chain ketoacid dehydrogenase kinase in complex with inhibitors | x-ray diffraction | A | ADP, MG, K, XER | 6 (best 0.75) |
| 8F5S | human branched chain ketoacid dehydrogenase kinase in complex with inhibitors | x-ray diffraction | A, B | ADP, MG, K, XGT, SO4 | 12 (best 0.75) |
| 9DI9 | Rat branched chain ketoacid dehydrogenase kinase in complex with inhibitor | x-ray diffraction | A | ADP, MG, K, A1A40, PO4 | 5 (best 0.78) |
| O14874 | AlphaFold monomer V2.0 prediction for [3-methyl-2-oxobutanoate dehydrogenase [lipoamide]] kinase… | predicted | A | — | — |
Ligands
- ADP · Adenosine-5'-diphosphate · in 4 records
- MG · Magnesium ion · in 4 records
- K · Potassium ion · in 3 records
- SO4 · Sulfate ion · in 2 records
- A1A40 · (3M)-6-fluoro-3-(2,4,5-trifluoro-3-methoxyphenyl)-1-benzothiophene-2-carboxylic acid · in 1 record
- PO4 · Phosphate ion · in 1 record
- XER · 3-chloro-5-fluorothieno[3,2-b]thiophene-2-carboxylic acid · in 1 record
- XGG · (2P)-2-[(4P)-4-{6-[(1-ethylcyclopropyl)methoxy]pyridin-3-yl}-1,3-thiazol-2-yl]benzoic acid · in 1 record
- XGT · (2M)-2-[2-(4-methylphenyl)-1,3-thiazol-4-yl]benzoic acid · in 1 record
Experiment against prediction
- 8F5J chain A against the predicted model O14874: TM-score 1.00, RMSD 0.44 Å
- 9DI9 chain A against the predicted model O14874: TM-score 0.99, RMSD 0.49 Å
- 8F5S chain A against the predicted model O14874: TM-score 0.98, RMSD 0.97 Å
- 8F5S chain B against the predicted model O14874: TM-score 0.98, RMSD 1.04 Å
- 8F5F chain A against the predicted model O14874: TM-score 0.97, RMSD 1.19 Å
- 8F5F chain B against the predicted model O14874: TM-score 0.97, RMSD 1.37 Å
Elsewhere
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