UniProt P07384
Calpain-1 catalytic subunit (P07384)
Calpain-1 catalytic subunit (UniProt P07384), EC 3.4.22.52: 6 experimental structures and 1 predicted model on GenesisL1, 4 ligands bound, 2 pockets. Binding sites, druggability and experiment against prediction (TM-score) in…
- UniProt
- P07384
- Protein
- Calpain-1 catalytic subunit
- EC
- 3.4.22.52
- Experimental structures
- 6
- Predicted models
- 1
- Ligands
- 4
- Pockets
- 2 · 0 records with a druggable one
Structures
7 records of P07384 in the MolNFT archive: 6 experimental, 1 predicted.
| Entry | Title | Method | Chains | Ligands | Pockets |
|---|---|---|---|---|---|
| 1ZCM | Human calpain protease core inhibited by ZLLYCH2F | x-ray diffraction | A | — | — |
| 1ZCM | Human calpain protease core inhibited by ZLLYCH2F | x-ray diffraction | A | — | — |
| 2ARY | Catalytic domain of Human Calpain-1 | x-ray diffraction | A, B | — | — |
| 2ARY | Catalytic domain of human calpain-1 | x-ray diffraction | A, B | — | — |
| 7W7O | The crystal structure of human Calpain-1 protease core in complex with 14a | x-ray diffraction | A | 06Q, H2S, CA | 1 (best 0.26) |
| 8GX3 | The crystal structure of human Calpain-1 protease core in complex with 14c | x-ray diffraction | A | KJ0, CA | 1 (best 0.31) |
| P07384 | AlphaFold monomer V2.0 prediction for calpain-1 catalytic subunit (P07384) | predicted | A | — | — |
Ligands
- CA · Calcium ion · in 2 records
- 06Q · N-[(2S)-3-(4-fluorophenyl)-1-oxidanylidene-1-[[(2S,3S)-3-oxidanyl-4-oxidanylidene-1-[(3S)-2-oxidanylidenepiperidin-3-yl]-4-[(phenylmethyl)amino]butan-2-yl]amino]propan-2-yl]-1-benzofuran-2-carboxamide · in 1 record
- H2S · Hydrosulfuric acid · in 1 record
- KJ0 · N-[(2S)-3-cyclohexyl-1-[[(2S,3S)-4-(cyclopropylamino)-3-oxidanyl-4-oxidanylidene-1-[(3S)-2-oxidanylidenepiperidin-3-yl]butan-2-yl]amino]-1-oxidanylidene-propan-2-yl]-1-benzofuran-2-carboxamide · in 1 record
Experiment against prediction
- 1ZCM chain A against the predicted model P07384: TM-score 0.99, RMSD 0.70 Å
- 1ZCM chain A against the predicted model P07384: TM-score 0.99, RMSD 0.70 Å
- 8GX3 chain A against the predicted model P07384: TM-score 0.99, RMSD 0.96 Å
- 7W7O chain A against the predicted model P07384: TM-score 0.98, RMSD 0.93 Å
- 2ARY chain A against the predicted model P07384: TM-score 0.97, RMSD 1.42 Å
- 2ARY chain A against the predicted model P07384: TM-score 0.97, RMSD 1.42 Å
- 2ARY chain B against the predicted model P07384: TM-score 0.96, RMSD 1.58 Å
- 2ARY chain B against the predicted model P07384: TM-score 0.96, RMSD 1.58 Å
Elsewhere
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