UniProt A5U6C6
4-hydroxy-tetrahydrodipicolinate reductase (A5U6C6)
4-hydroxy-tetrahydrodipicolinate reductase (UniProt A5U6C6), EC 1.17.1.8: 5 experimental structures and 1 predicted model on GenesisL1, 9 ligands bound, 7 pockets. Binding sites, druggability and experiment against prediction…
- UniProt
- A5U6C6
- Protein
- 4-hydroxy-tetrahydrodipicolinate reductase
- EC
- 1.17.1.8
- Experimental structures
- 5
- Predicted models
- 1
- Ligands
- 9
- Pockets
- 7 · 1 record with a druggable one
Structures
6 records of A5U6C6 in the MolNFT archive: 5 experimental, 1 predicted.
| Entry | Title | Method | Chains | Ligands | Pockets |
|---|---|---|---|---|---|
| 5TEK | Apo Structure of 4-Hydroxy-tetrahydrodipicolinate Reductase from Mycobacterium tuberculosis | x-ray diffraction | A, B | CL, NA | 7 (best 0.61) |
| 5TEK | Apo structure of 4-hydroxy-tetrahydrodipicolinate reductase from mycobacterium tuberculosis | x-ray diffraction | A, B | CL, NA | — |
| 5TJY | Structure of 4-hydroxy-tetrahydrodipicolinate reductase from mycobacterium tuberculosis with 2,6… | x-ray diffraction | A | PDC, NAI, SO4, BEZ, NA, CL | — |
| 5TJZ | Structure of 4-hydroxytetrahydrodipicolinate reductase from mycobacterium tuberculosis with NADPH… | x-ray diffraction | A | PDC, BEZ, NAP, AE3, CL, SO4 | — |
| 5UGV | Dapb from mycobacterium tuberculosis | x-ray diffraction | A, B | NAD, SO4 | — |
| A5U6C6 | AlphaFold monomer V2.0 prediction for 4-hydroxy- tetrahydrodipicolinate reductase (A5U6C6) | predicted | A | — | — |
Ligands
- CL · Chloride ion · in 4 records
- NA · Sodium ion · in 3 records
- SO4 · Sulfate ion · in 3 records
- BEZ · Benzoic acid · in 2 records
- PDC · Pyridine-2,6-dicarboxylic acid · in 2 records
- AE3 · 2-(2-ethoxyethoxy)ethanol · in 1 record
- NAD · Nicotinamide-adenine-dinucleotide · in 1 record
- NAI · 1,4-dihydronicotinamide adenine dinucleotide · in 1 record
- NAP · Nadp nicotinamide-adenine-dinucleotide phosphate · in 1 record
Experiment against prediction
- 5TEK chain A against the predicted model A5U6C6: TM-score 0.92, RMSD 1.53 Å
- 5TEK chain A against the predicted model A5U6C6: TM-score 0.92, RMSD 1.53 Å
- 5TEK chain B against the predicted model A5U6C6: TM-score 0.92, RMSD 1.63 Å
- 5TEK chain B against the predicted model A5U6C6: TM-score 0.92, RMSD 1.63 Å
- 5UGV chain A against the predicted model A5U6C6: TM-score 0.93, RMSD 1.64 Å
- 5UGV chain B against the predicted model A5U6C6: TM-score 0.90, RMSD 1.94 Å
- 5TJZ chain A against the predicted model A5U6C6: TM-score 0.85, RMSD 2.57 Å
- 5TJY chain A against the predicted model A5U6C6: TM-score 0.85, RMSD 2.61 Å
Elsewhere
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