UniProt Q07912
Activated CDC42 kinase 1 (Q07912)
Activated CDC42 kinase 1 (UniProt Q07912), EC 2.7.10.2, 2.7.11.1: 27 experimental structures and 1 predicted model on GenesisL1, 7 ligands bound, 8 pockets. Binding sites, druggability and experiment against prediction (TM-score)…
- UniProt
- Q07912
- Protein
- Activated CDC42 kinase 1
- EC
- 2.7.10.2, 2.7.11.1
- Experimental structures
- 27
- Predicted models
- 1
- Ligands
- 7
- Pockets
- 8 · 4 records with a druggable one
Structures
28 records of Q07912 in the MolNFT archive: 27 experimental, 1 predicted.
| Entry | Title | Method | Chains | Ligands | Pockets |
|---|---|---|---|---|---|
| 1CF4 | CDC42/ACK GTPase-binding domain complex | solution nmr | B | — | — |
| 1CF4 | CDC42/ACK GTPase-binding domain complex | solution nmr | B | — | — |
| 1U46 | Crystal Structure of the Unphosphorylated Kinase Domain of the Tyrosine Kinase ACK1 | x-ray diffraction | A, B | — | — |
| 1U46 | Crystal structure of the unphosphorylated kinase domain of the tyrosine kinase ACK1 | x-ray diffraction | A, B | — | — |
| 1U4D | Structure of the ACK1 Kinase Domain bound to Debromohymenialdisine | x-ray diffraction | A, B | — | — |
| 1U4D | Structure of the ACK1 kinase domain bound to debromohymenialdisine | x-ray diffraction | A, B | — | — |
| 1U54 | Crystal Structures of the Phosphorylated and Unphosphorylated Kinase Domains of the… | x-ray diffraction | A, B | — | — |
| 1U54 | Crystal structures of the phosphorylated and unphosphorylated kinase domains of the… | x-ray diffraction | A, B | — | — |
| 3EQP | Crystal Structure of Ack1 with compound T95 | x-ray diffraction | B, A | — | — |
| 3EQP | Crystal structure of ACK1 with compound T95 | x-ray diffraction | B, A | — | — |
| 3EQR | Crystal Structure of Ack1 with compound T74 | x-ray diffraction | A, B | — | — |
| 3EQR | Crystal structure of ACK1 with compound T74 | x-ray diffraction | A, B | — | — |
| 4EWH | Co-crystal structure of ACK1 with inhibitor | x-ray diffraction | B, A | — | — |
| 4EWH | Co-crystal structure of ACK1 with inhibitor | x-ray diffraction | B, A | — | — |
| 4HZR | Crystal structure of Ack1 kinase domain | x-ray diffraction | A, B | — | — |
| 4HZR | Crystal structure of ACK1 kinase domain | x-ray diffraction | A, B | — | — |
| 4HZS | Crystal structure of Ack1 kinase domain with C-terminal SH3 domain | x-ray diffraction | A, B, C, D | — | — |
| 4HZS | Crystal structure of ACK1 kinase domain with C-terminal SH3 domain | x-ray diffraction | A, B, C, D | — | — |
| 4ID7 | ACK1 kinase in complex with the inhibitor cis-3-[8-amino-1-(4-phenoxyphenyl)imidazo[1,5-a]pyrazin-3… | x-ray diffraction | A | — | — |
| 4ID7 | ACK1 kinase in complex with the inhibitor cis-3-[8-amino-1-(4… | x-ray diffraction | A | — | — |
| 5ZXB | Crystal structure of ACK1 with compound 10d | x-ray diffraction | A, B | 9KO | 3 (best 0.69) |
| 5ZXB | Crystal structure of ACK1 with compound 10D | x-ray diffraction | A, B | 9KO | — |
| 6VQM | Crystal structure analysis of human ACK1 | x-ray diffraction | A, B | R7P, SO4 | — |
| 7KP6 | Structure of ACK1 kinase in complex with a selective inhibitor | x-ray diffraction | A, B | WTP, CL | — |
| 8FE9 | Crystal structure of Ack1 kinase K161Q mutant in complex with the selective inhibitor (R)-9b | x-ray diffraction | A | WTP | 2 (best 0.64) |
| 8FZ3 | Sterile Alpha Motif of Human Translocation ETS Leukemia, Non-Polymer Crystal Form | x-ray diffraction | A, B, C, D | CL, PO4 | 2 (best 0.74) |
| 8Q5P | Structure of the lysine methyltransferase SETD2 in complex with a peptide derived from human… | x-ray diffraction | B | SAM | 1 (best 0.65) |
| Q07912 | AlphaFold monomer V2.0 prediction for activated CDC42 kinase 1 (Q07912) | predicted | A | — | — |
Ligands
- 9KO · N-{3-[7-{[6-(4-acetylpiperazin-1-yl)pyridin-3-yl]amino}-1-methyl-2-oxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]-4-methylphenyl}-3-(trifluoromethyl)benzamide · in 2 records
- CL · Chloride ion · in 2 records
- WTP · 5-chloro-N~2~-[4-(4-methylpiperazin-1-yl)phenyl]-N~4~-{[(2R)-oxolan-2-yl]methyl}pyrimidine-2,4-diamine · in 2 records
- PO4 · Phosphate ion · in 1 record
- R7P · 2-({4-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-2-methoxyphenyl}amino)-9-methyl-5,7-dihydro-6H-pyrimido[5,4-d][1,3]benzodiazepin-6-one · in 1 record
- SAM · S-adenosylmethionine · in 1 record
- SO4 · Sulfate ion · in 1 record
Experiment against prediction
- 4HZS chain A against the predicted model Q07912: TM-score 0.98, RMSD 1.30 Å
- 4HZS chain A against the predicted model Q07912: TM-score 0.98, RMSD 1.30 Å
- 4HZS chain D against the predicted model Q07912: TM-score 0.98, RMSD 1.30 Å
- 4HZS chain D against the predicted model Q07912: TM-score 0.98, RMSD 1.30 Å
- 4HZS chain B against the predicted model Q07912: TM-score 0.98, RMSD 1.30 Å
- 4HZS chain B against the predicted model Q07912: TM-score 0.98, RMSD 1.30 Å
- 4HZS chain C against the predicted model Q07912: TM-score 0.98, RMSD 1.31 Å
- 4HZS chain C against the predicted model Q07912: TM-score 0.98, RMSD 1.31 Å
- 4HZR chain B against the predicted model Q07912: TM-score 0.97, RMSD 1.22 Å
- 4HZR chain B against the predicted model Q07912: TM-score 0.97, RMSD 1.22 Å
Elsewhere
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