UniProt Q8KLK7
Q8KLK7
Q8KLK7 (UniProt Q8KLK7): 10 experimental structures and 1 predicted model on GenesisL1, 3 ligands bound. Binding sites, druggability and experiment against prediction (TM-score) in GL1X.
- UniProt
- Q8KLK7
- Experimental structures
- 10
- Predicted models
- 1
- Ligands
- 3
Structures
11 records of Q8KLK7 in the MolNFT archive: 10 experimental, 1 predicted.
| Entry | Title | Method | Chains | Ligands | Pockets |
|---|---|---|---|---|---|
| 2NP9 | Crystal structure of a dioxygenase in the Crotonase superfamily | x-ray diffraction | A, B, C | — | — |
| 2NP9 | Crystal structure of a dioxygenase in the crotonase superfamily | x-ray diffraction | A, B, C | — | — |
| 2PG8 | Crystal structure of R254K mutanat of DpgC with bound substrate analog | x-ray diffraction | A, B, C | — | — |
| 2PG8 | Crystal structure of R254K mutanat of dpgc with bound substrate analog | x-ray diffraction | A, B, C | — | — |
| 4YLH | Crystal structure of DpgC with bound substrate analog and Xe on oxygen diffusion pathway | x-ray diffraction | A, B, C, D, E, F, G, H, I, J, K, L | — | — |
| 4YLH | Crystal structure of dpgc with bound substrate analog and xe on oxygen diffusion pathway | x-ray diffraction | A, B, C, D, E, F, G, H, I, J, K, L | — | — |
| 5KAG | Crystal structure of a dioxygenase in the crotonase superfamily in P21 | x-ray diffraction | A, B, C, D, E, F, G, H, I, J, K, L | YE1, OXY | — |
| 5KAH | Crystal structure of a dioxygenase in the crotonase superfamily in P21, V425T mutant | x-ray diffraction | A, B, C, D, E, F, G, H, I, J, K, L | YE1 | — |
| 5KAJ | Crystal structure of a dioxygenase in the Crotonase superfamily in P21, A319C mutant | x-ray diffraction | A, B, C, D, E, F, G, H, I, J, K, L | YE2 | — |
| 5KAJ | Crystal structure of a dioxygenase in the crotonase superfamily in P21, A319C mutant | x-ray diffraction | A, B, C, D, E, F, G, H, I, J, K, L | YE2 | — |
| Q8KLK7 | AlphaFold monomer V2.0 prediction for (3,5-DIHYDROXYPHENYL)ACETYL-CoA 1,2-dioxygenase (Q8KLK7) | predicted | A | — | — |
Ligands
- YE1 · [(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]methyl (3R)-4-({3-[(2-{[(3,5-dihydroxyphenyl)acetyl]amino}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl dihydrogen diphosphate · in 2 records
- YE2 · [[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-4-oxidanyl-3-phosphonooxy-oxolan-2-yl]methoxy-oxidanyl-phosphoryl] [(3~{R})-4-[[3-[2-[(~{E})-2-[3,5-bis(oxidanyl)phenyl]-1-oxidanyl-ethenyl]sulfanylethylamino]-3-oxidanylidene-propyl]amino]-2,2-dimethyl-3-oxidanyl-4-oxidanylidene-butyl] hydrogen phosphate · in 2 records
- OXY · Oxygen molecule · in 1 record
Experiment against prediction
- 5KAH chain C against the predicted model Q8KLK7: TM-score 1.00, RMSD 0.35 Å
- 5KAH chain B against the predicted model Q8KLK7: TM-score 1.00, RMSD 0.36 Å
- 5KAJ chain I against the predicted model Q8KLK7: TM-score 1.00, RMSD 0.36 Å
- 5KAJ chain I against the predicted model Q8KLK7: TM-score 1.00, RMSD 0.36 Å
- 5KAH chain H against the predicted model Q8KLK7: TM-score 1.00, RMSD 0.37 Å
- 5KAJ chain D against the predicted model Q8KLK7: TM-score 1.00, RMSD 0.38 Å
- 5KAJ chain D against the predicted model Q8KLK7: TM-score 1.00, RMSD 0.38 Å
- 5KAJ chain F against the predicted model Q8KLK7: TM-score 1.00, RMSD 0.38 Å
- 5KAJ chain F against the predicted model Q8KLK7: TM-score 1.00, RMSD 0.38 Å
- 5KAJ chain L against the predicted model Q8KLK7: TM-score 1.00, RMSD 0.38 Å
Elsewhere
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