UniProt Q72AS3
Periplasmic [NiFeSe] hydrogenase, large subunit, selenocysteine-containing (Q72AS3)
Periplasmic [NiFeSe] hydrogenase, large subunit, selenocysteine-containing (UniProt Q72AS3), EC 1.12.7.2: 32 experimental structures on GenesisL1, 9 ligands bound, 36 pockets. Binding sites, pockets, druggability and 3D…
- UniProt
- Q72AS3
- Protein
- Periplasmic [NiFeSe] hydrogenase, large subunit, selenocysteine-containing
- EC
- 1.12.7.2
- Experimental structures
- 32
- Predicted models
- 0
- Ligands
- 9
- Pockets
- 36 · 4 records with a druggable one
Structures
32 records of Q72AS3 in the MolNFT archive: 32 experimental, 0 predicted.
| Entry | Title | Method | Chains | Ligands | Pockets |
|---|---|---|---|---|---|
| 2WPN | Structure of the oxidised, as-isolated NiFeSe hydrogenase from D. vulgaris Hildenborough | x-ray diffraction | B | — | — |
| 2WPN | Structure of the oxidised, as-isolated nifese hydrogenase from D. vulgaris hildenborough | x-ray diffraction | B | — | — |
| 3ZE6 | 3D structure of the Ni-Fe-Se hydrogenase from D. vulgaris Hildenborough in the as-isolated oxidized… | x-ray diffraction | B | — | — |
| 3ZE6 | 3D structure of the ni-fe-se hydrogenase from D. vulgaris hildenborough in the as-isolated oxidized… | x-ray diffraction | B | — | — |
| 3ZE7 | 3D structure of the Ni-Fe-Se hydrogenase from D. vulgaris Hildenborough in the reduced state at… | x-ray diffraction | B | — | — |
| 3ZE7 | 3D structure of the ni-fe-se hydrogenase from D. vulgaris hildenborough in the reduced state at… | x-ray diffraction | B | — | — |
| 3ZE8 | 3D structure of the Ni-Fe-Se hydrogenase from D. vulgaris Hildenborough in the reduced state at… | x-ray diffraction | B | — | — |
| 3ZE8 | 3D structure of the ni-fe-se hydrogenase from D. vulgaris hildenborough in the reduced state at… | x-ray diffraction | B | — | — |
| 3ZE9 | 3D structure of the NiFeSe hydrogenase from D. vulgaris Hildenborough in the oxidized as-isolated… | x-ray diffraction | B | — | — |
| 3ZE9 | 3D structure of the nifese hydrogenase from D. vulgaris hildenborough in the oxidized as-isolated… | x-ray diffraction | B | — | — |
| 3ZEA | 3D structure of the NiFeSe hydrogenase from D. vulgaris Hildenborough in the reduced state at 1.82… | x-ray diffraction | B | — | — |
| 3ZEA | 3D structure of the nifese hydrogenase from D. vulgaris hildenborough in the reduced state at 1.82… | x-ray diffraction | B | — | — |
| 5JSH | The 3D structure of recombinant [nifese] hydrogenase from desulfovibrio vulgaris hildenborough in… | x-ray diffraction | B | — | — |
| 5JSK | The 3D structure of [NiFeSe] hydrogenase from Desulfovibrio vulgaris Hildenborough in the reduced… | x-ray diffraction | B | SF4, NI, FCO, FE2, H2S | — |
| 5JSK | The 3D structure of [nifese] hydrogenase from desulfovibrio vulgaris hildenborough in the reduced… | x-ray diffraction | B | — | — |
| 5JSY | The 3D structure of the Ni-reconstituted U489C variant of [NiFeSe] hydrogenase from Desulfovibrio… | x-ray diffraction | B | SF4, FCO, NI, FE2, H2S, CL | 3 (best 0.80) |
| 5JSY | The 3D structure of the ni-reconstituted U489C variant of [nifese] hydrogenase from desulfovibrio… | x-ray diffraction | B | — | — |
| 5JT1 | The 3D structure of Ni-reconstituted U489C variant of [NiFeSe] hydrogenase from Desulfovibrio… | x-ray diffraction | B | SF4, 6ML, FCO, NI, FE2, H2S | — |
| 5JT1 | The 3D structure of ni-reconstituted U489C variant of [nifese] hydrogenase from desulfovibrio… | x-ray diffraction | B | SF4, 6ML, FCO, NI, FE2, H2S | 5 (best 0.80) |
| 6RTP | The 3D structure of [nifese] hydrogenase G50T variant from desulfovibrio vulgaris hildenborough at… | x-ray diffraction | B | SF4, 6ML, FCO, NI, FE2, H2S | — |
| 6RU9 | The 3D structure of [nifese] hydrogenase G491A variant from desulfovibrio vulgaris hildenborough at… | x-ray diffraction | B | SF4, 6ML, FCO, NI, FE2, H2S | — |
| 6RUC | The 3D structure of [nifese] hydrogenase G491S variant from desulfovibrio vulgaris hildenborough at… | x-ray diffraction | B | SF4, 6ML, FCO, NI, FE2, H2S | — |
| 6Z7R | Structure of [NiFeSe] hydrogenase from Desulfovibrio vulgaris hildenborough pressurized with… | x-ray diffraction | B, D | SF4, 6ML, KR, FCO, NI, FE2 | 9 (best 0.82) |
| 6Z7R | Structure of [nifese] hydrogenase from desulfovibrio vulgaris hildenborough pressurized with… | x-ray diffraction | B, D | SF4, 6ML, KR, FCO, NI, FE2 | — |
| 6Z8J | Structure of [NiFeSe] hydrogenase from Desulfovibrio vulgaris hildenborough pressurized with Oxygen… | x-ray diffraction | B, D | SF4, 6ML, FCO, NI, FE2, H2S | — |
| 6Z8J | Structure of [nifese] hydrogenase from desulfovibrio vulgaris hildenborough pressurized with oxygen… | x-ray diffraction | B, D | SF4, 6ML, FCO, NI, FE2, H2S | — |
| 6Z8M | Structure of [nifese] hydrogenase G491S variant from desulfovibrio vulgaris hildenborough… | x-ray diffraction | B | SF4, 6ML, FCO, NI, FE2, H2S | — |
| 6Z8O | Structure of [nifese] hydrogenase G491A variant from desulfovibrio vulgaris hildenborough… | x-ray diffraction | B, D | SF4, 6ML, KR, FCO, NI, FE2 | — |
| 6Z9G | Structure of [NiFeSe] hydrogenase G491A variant from Desulfovibrio vulgaris Hildenborough… | x-ray diffraction | B, D, F, H | SF4, 6ML, FCO, NI, FE2, H2S | 19 (best 0.82) |
| 6Z9G | Structure of [nifese] hydrogenase G491A variant from desulfovibrio vulgaris hildenborough… | x-ray diffraction | B, D, F, H | SF4, 6ML, FCO, NI, FE2, H2S | — |
| 6Z9O | Structure of [nifese] hydrogenase G491S variant from desulfovibrio vulgaris hildenborough… | x-ray diffraction | B | SF4, 6ML, FCO, NI, FE2, H2S | — |
| 6ZA1 | Structure of [nifese] hydrogenase G491A variant from desulfovibrio vulgaris hildenborough… | x-ray diffraction | B | SF4, 6ML, OXY, FCO, NI, FE2 | — |
Ligands
- FCO · Carbonmonoxide-(dicyano) iron · in 17 records
- FE2 · Fe (II) ion · in 17 records
- H2S · Hydrosulfuric acid · in 17 records
- NI · Nickel (II) ion · in 17 records
- SF4 · Iron/sulfur cluster · in 17 records
- 6ML · oxygen-damaged SF4 · in 15 records
- CL · Chloride ion · in 11 records
- OXY · Oxygen molecule · in 5 records
- KR · Krypton · in 3 records
Elsewhere
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