UniProt P97287
Induced myeloid leukemia cell differentiation protein mcl-1 homolog (P97287)
Induced myeloid leukemia cell differentiation protein mcl-1 homolog (UniProt P97287): 29 experimental structures and 1 predicted model on GenesisL1, 4 ligands bound, 4 pockets. Binding sites, druggability and experiment against…
- UniProt
- P97287
- Protein
- Induced myeloid leukemia cell differentiation protein mcl-1 homolog
- Experimental structures
- 29
- Predicted models
- 1
- Ligands
- 4
- Pockets
- 4 · 1 record with a druggable one
Structures
30 records of P97287 in the MolNFT archive: 29 experimental, 1 predicted.
| Entry | Title | Method | Chains | Ligands | Pockets |
|---|---|---|---|---|---|
| 1WSX | Solution structure of MCL-1 | solution nmr | A | — | — |
| 1WSX | Solution structure of mcl-1 | solution nmr | A | — | — |
| 2JM6 | Solution structure of MCL-1 complexed with NOXAB | solution nmr | B | — | — |
| 2JM6 | Solution structure of mcl-1 complexed with noxab | solution nmr | B | — | — |
| 2NL9 | Crystal structure of the Mcl-1:Bim BH3 complex | x-ray diffraction | A | — | — |
| 2NL9 | Crystal structure of the mcl-1:BIM BH3 complex | x-ray diffraction | A | — | — |
| 2NLA | Crystal structure of the Mcl-1:mNoxaB BH3 complex | x-ray diffraction | A | — | — |
| 2NLA | Crystal structure of the mcl-1:MNOXAB BH3 complex | x-ray diffraction | A | — | — |
| 2ROC | Solution structure of Mcl-1 Complexed with Puma | solution nmr | A | — | — |
| 2ROC | Solution structure of mcl-1 complexed with puma | solution nmr | A | — | — |
| 2ROD | Solution Structure of MCL-1 Complexed with NoxaA | solution nmr | A | — | — |
| 2ROD | Solution structure of mcl-1 complexed with noxaa | solution nmr | A | — | — |
| 3D7V | Crystal structure of Mcl-1 in complex with an Mcl-1 selective BH3 ligand | x-ray diffraction | A | — | — |
| 3D7V | Crystal structure of mcl-1 in complex with an mcl-1 selective BH3 ligand | x-ray diffraction | A | — | — |
| 3IO9 | BimL12Y in complex with Mcl-1 | x-ray diffraction | A | — | — |
| 3IO9 | BIML12Y in complex with mcl-1 | x-ray diffraction | A | — | — |
| 4BPI | Mcl-1 bound to alpha beta Puma BH3 peptide 2 | x-ray diffraction | A | — | — |
| 4BPI | Mcl-1 bound to alpha beta puma BH3 peptide 2 | x-ray diffraction | A | — | — |
| 4BPJ | Mcl-1 bound to alpha beta Puma BH3 peptide 3 | x-ray diffraction | A | — | — |
| 4BPJ | Mcl-1 bound to alpha beta puma BH3 peptide 3 | x-ray diffraction | A | — | — |
| 4G35 | Mcl-1 in complex with a biphenyl cross-linked Noxa peptide. | x-ray diffraction | A | — | — |
| 4G35 | Mcl-1 in complex with a biphenyl cross-linked noxa peptide. | x-ray diffraction | A | — | — |
| 5MES | MCL1 Fab complex in complex with compound 29 | x-ray diffraction | A | 7LT | — |
| 5MES | MCL1 Fab complex in complex with compound 29 | x-ray diffraction | A | 7LT | — |
| 5MEV | MCL1 Fab complex in complex with compound 21 | x-ray diffraction | A | 7LW | 2 (best 0.41) |
| 5MEV | MCL1 Fab complex in complex with compound 21 | x-ray diffraction | A | 7LW | — |
| 5VX2 | Mcl-1 in complex with bim-H3PC-rt | x-ray diffraction | A, C | — | — |
| 6DM8 | Understanding the Species Selectivity of Myeloid cell leukemia-1 (Mcl-1) inhibitors | x-ray diffraction | A, B, C, D, E, F, G, H | GLC, 6AK | — |
| 6DM8 | Understanding the species selectivity of myeloid cell leukemia-1 (mcl- 1) inhibitors | x-ray diffraction | A, B, C, D, E, F, G, H | GLC, 6AK | — |
| P97287 | AlphaFold monomer V2.0 prediction for induced myeloid leukemia cell differentiation protein mcl-1… | predicted | A | — | 2 (best 0.65) |
Ligands
- 6AK · 4-{8-chloro-11-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-1-oxo-7-(1,3,5-trimethyl-1H-pyrazol-4-yl)-4,5-dihydro-1H-[1,4]diazepino[1,2-a]indol-2(3H)-yl}-1-methyl-1H-indole-6-carboxylic acid · in 2 records
- 7LT · (5~{R},13~{S},17~{S})-5-[[4-chloranyl-3-(2-phenylethyl)phenyl]methyl]-13-[(4-chlorophenyl) methyl]-8-methyl-1,4,8,12,16-pentazatricyclo[15.8.1.0^{20,25}]hexacosa-20(25),21, 23-triene-3,7,15,26-tetrone · in 2 records
- 7LW · (5~{R},13~{S},17~{S})-5-[(3,4-dichlorophenyl)methyl]-8-methyl-13-[(4-methylsulfonylphenyl)methyl]-1,4,8,12, 16-pentazatricyclo[15.8.1.0^{20,25}]hexacosa-20,22,24-triene-3,7,15,26-tetrone · in 2 records
- GLC · alpha-D-glucopyranose · in 2 records
Experiment against prediction
- 5VX2 chain C against the predicted model P97287: TM-score 0.98, RMSD 0.76 Å
- 5VX2 chain A against the predicted model P97287: TM-score 0.98, RMSD 0.76 Å
- 2NLA chain A against the predicted model P97287: TM-score 0.97, RMSD 0.77 Å
- 2NLA chain A against the predicted model P97287: TM-score 0.97, RMSD 0.77 Å
- 5MES chain A against the predicted model P97287: TM-score 0.97, RMSD 0.90 Å
- 5MES chain A against the predicted model P97287: TM-score 0.97, RMSD 0.90 Å
- 4G35 chain A against the predicted model P97287: TM-score 0.97, RMSD 0.81 Å
- 4G35 chain A against the predicted model P97287: TM-score 0.97, RMSD 0.81 Å
- 5MEV chain A against the predicted model Q07820: TM-score 0.97, RMSD 0.90 Å
- 5MES chain A against the predicted model Q07820: TM-score 0.96, RMSD 0.97 Å
Elsewhere
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