UniProt P62623
P62623
P62623 (UniProt P62623): 48 experimental structures and 1 predicted model on GenesisL1. Binding sites, druggability and experiment against prediction (TM-score) in GL1X.
- UniProt
- P62623
- Experimental structures
- 48
- Predicted models
- 1
Structures
49 records of P62623 in the MolNFT archive: 48 experimental, 1 predicted.
| Entry | Title | Method | Chains | Ligands | Pockets |
|---|---|---|---|---|---|
| 3F7T | Structure of active IspH shows a novel fold with a [3Fe-4S] cluster in the catalytic centre | x-ray diffraction | A, B | — | — |
| 3F7T | Structure of active isph shows a novel fold with a [3FE-4S] cluster in the catalytic centre | x-ray diffraction | A, B | — | — |
| 3KE8 | Crystal structure of IspH:HMBPP-complex | x-ray diffraction | A, B | — | — |
| 3KE8 | Crystal structure of ISPH:HMBPP-complex | x-ray diffraction | A, B | — | — |
| 3KE9 | Crystal structure of IspH:Intermediate-complex | x-ray diffraction | A, B | — | — |
| 3KE9 | Crystal structure of ISPH:INTERMEDIATE-complex | x-ray diffraction | A, B | — | — |
| 3KEF | Crystal structure of IspH:DMAPP-complex | x-ray diffraction | A, B | — | — |
| 3KEF | Crystal structure of ISPH:DMAPP-complex | x-ray diffraction | A, B | — | — |
| 3KEL | Crystal Structure of IspH:PP complex | x-ray diffraction | A, B | — | — |
| 3KEL | Crystal structure of ISPH:PP complex | x-ray diffraction | A, B | — | — |
| 3KEM | Crystal structure of IspH:IPP complex | x-ray diffraction | A, B | — | — |
| 3KEM | Crystal structure of ISPH:IPP complex | x-ray diffraction | A, B | — | — |
| 3SZL | IspH:Ligand Mutants - wt 70sec | x-ray diffraction | A, B | — | — |
| 3SZL | ISPH:LIGAND mutants - wt 70SEC | x-ray diffraction | A, B | — | — |
| 3SZO | IspH:HMBPP complex after 3 minutes X-ray pre-exposure | x-ray diffraction | A, B | — | — |
| 3SZO | ISPH:HMBPP complex after 3 minutes X-ray pre-exposure | x-ray diffraction | A, B | — | — |
| 3SZU | IspH:HMBPP complex structure of E126Q mutant | x-ray diffraction | A, B | — | — |
| 3SZU | ISPH:HMBPP complex structure of E126Q mutant | x-ray diffraction | A, B | — | — |
| 3T0F | IspH:HMBPP (substrate) structure of the E126D mutant | x-ray diffraction | A, B | — | — |
| 3T0F | ISPH:HMBPP (substrate) structure of the E126D mutant | x-ray diffraction | A, B | — | — |
| 3T0G | IspH:HMBPP (substrate) structure of the T167C mutant | x-ray diffraction | A, B | — | — |
| 3T0G | ISPH:HMBPP (substrate) structure of the T167C mutant | x-ray diffraction | A, B | — | — |
| 3URK | IspH in complex with propynyl diphosphate (1061) | x-ray diffraction | A, B | — | — |
| 3URK | Isph in complex with propynyl diphosphate (1061) | x-ray diffraction | A, B | — | — |
| 3UTC | Ec_IspH in complex with (E)-4-hydroxybut-3-enyl diphosphate | x-ray diffraction | A, B | — | — |
| 3UTC | EC_ISPH in complex with (E)-4-hydroxybut-3-enyl diphosphate | x-ray diffraction | A, B | — | — |
| 3UTD | Ec_IspH in complex with 4-oxopentyl diphosphate | x-ray diffraction | A, B | — | — |
| 3UTD | EC_ISPH in complex with 4-oxopentyl diphosphate | x-ray diffraction | A, B | — | — |
| 3UV3 | Ec_IspH in complex with but-2-ynyl diphosphate (1086) | x-ray diffraction | A, B | — | — |
| 3UV3 | EC_ISPH in complex with but-2-ynyl diphosphate (1086) | x-ray diffraction | A, B | — | — |
| 3UV6 | Ec_IspH in complex with 4-hydroxybutyl diphosphate (1301) | x-ray diffraction | A, B | — | — |
| 3UV6 | EC_ISPH in complex with 4-hydroxybutyl diphosphate (1301) | x-ray diffraction | A, B | — | — |
| 3UV7 | Ec_IspH in complex with buta-2,3-dienyl diphosphate (1300) | x-ray diffraction | A, B | — | — |
| 3UV7 | EC_ISPH in complex with buta-2,3-dienyl diphosphate (1300) | x-ray diffraction | A, B | — | — |
| 3UWM | Ec_IspH in complex with 4-oxobutyl diphosphate (1302) | x-ray diffraction | A, B | — | — |
| 3UWM | EC_ISPH in complex with 4-oxobutyl diphosphate (1302) | x-ray diffraction | A, B | — | — |
| 3ZGL | Crystal structures of Escherichia coli IspH in complex with AMBPP a potent inhibitor of the… | x-ray diffraction | A, B | — | — |
| 3ZGL | Crystal structures of escherichia COLI isph in complex with ambpp a potent inhibitor of the… | x-ray diffraction | A, B | — | — |
| 3ZGN | Crystal structures of Escherichia coli IspH in complex with TMBPP a potent inhibitor of the… | x-ray diffraction | A, B | — | — |
| 3ZGN | Crystal structures of escherichia COLI isph in complex with tmbpp a potent inhibitor of the… | x-ray diffraction | A, B | — | — |
| 4EB3 | Crystal structure of IspH in complex with iso-HMBPP | x-ray diffraction | A, B | — | — |
| 4EB3 | Crystal structure of isph in complex with iso-hmbpp | x-ray diffraction | A, B | — | — |
| 4H4C | IspH in complex with (E)-4-fluoro-3-methylbut-2-enyl diphosphate | x-ray diffraction | A, B | — | — |
| 4H4C | Isph in complex with (E)-4-fluoro-3-methylbut-2-enyl diphosphate | x-ray diffraction | A, B | — | — |
| 4H4D | IspH in complex with (E)-4-amino-3-methylbut-2-enyl diphosphate | x-ray diffraction | A, B | — | — |
| 4H4D | Isph in complex with (E)-4-amino-3-methylbut-2-enyl diphosphate | x-ray diffraction | A, B | — | — |
| 4H4E | IspH in complex with (E)-4-mercapto-3-methylbut-2-enyl diphosphate | x-ray diffraction | A, B | — | — |
| 4H4E | Isph in complex with (E)-4-mercapto-3-methylbut-2-enyl diphosphate | x-ray diffraction | A, B | — | — |
| P62623 | AlphaFold monomer V2.0 prediction for 4-hydroxy-3-methylbut-2-enyl diphosphate reductase (P62623) | predicted | A | — | — |
Experiment against prediction
- 4EB3 chain B against the predicted model P62623: TM-score 0.99, RMSD 0.65 Å
- 4EB3 chain B against the predicted model P62623: TM-score 0.99, RMSD 0.65 Å
- 3F7T chain A against the predicted model P62623: TM-score 0.99, RMSD 0.68 Å
- 3F7T chain A against the predicted model P62623: TM-score 0.99, RMSD 0.68 Å
- 3UWM chain B against the predicted model P62623: TM-score 0.99, RMSD 0.67 Å
- 3UWM chain B against the predicted model P62623: TM-score 0.99, RMSD 0.67 Å
- 3UTC chain B against the predicted model P62623: TM-score 0.99, RMSD 0.67 Å
- 3UTC chain B against the predicted model P62623: TM-score 0.99, RMSD 0.67 Å
- 3KEM chain A against the predicted model P62623: TM-score 0.99, RMSD 0.68 Å
- 3KEM chain A against the predicted model P62623: TM-score 0.99, RMSD 0.68 Å
Elsewhere
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