UniProt O14965
Aurora kinase A (O14965)
Aurora kinase A (UniProt O14965), EC 2.7.11.1: 297 experimental structures and 1 predicted model on GenesisL1, 76 ligands bound, 74 pockets. Binding sites, druggability and experiment against prediction (TM-score) in GL1X.
- UniProt
- O14965
- Protein
- Aurora kinase A
- EC
- 2.7.11.1
- Experimental structures
- 297
- Predicted models
- 1
- Ligands
- 76
- Pockets
- 74 · 30 records with a druggable one
Structures
298 records of O14965 in the MolNFT archive: 297 experimental, 1 predicted.
| Entry | Title | Method | Chains | Ligands | Pockets |
|---|---|---|---|---|---|
| 1MQ4 | Crystal Structure of Aurora-A Protein Kinase | x-ray diffraction | A | — | — |
| 1MQ4 | Crystal structure of aurora-a protein kinase | x-ray diffraction | A | — | — |
| 1MUO | Crystal structure of aurora-2, an oncogenic serine-threonine kinase | x-ray diffraction | A | — | — |
| 1MUO | Crystal structure of aurora-2, an oncogenic serine- threonine kinase | x-ray diffraction | A | — | — |
| 1OL5 | Structure of Aurora-A 122-403, phosphorylated on Thr287, Thr288 and bound to TPX2 1-43 | x-ray diffraction | A | — | — |
| 1OL5 | Structure of aurora-a 122-403, phosphorylated on THR287, THR288 and bound to TPX2 1-43 | x-ray diffraction | A | — | — |
| 1OL6 | Structure of unphosphorylated D274N mutant of Aurora-A | x-ray diffraction | A | — | — |
| 1OL6 | Structure of unphosphorylated D274N mutant of aurora-a | x-ray diffraction | A | — | — |
| 1OL7 | Structure of Human Aurora-A 122-403 phosphorylated on Thr287, Thr288 | x-ray diffraction | A | — | — |
| 1OL7 | Structure of human aurora-a 122-403 phosphorylated on THR287, THR288 | x-ray diffraction | A | — | — |
| 2BMC | Aurora-2 T287D T288D complexed with PHA-680632 | x-ray diffraction | A, B, C, D, E, F | — | — |
| 2BMC | Aurora-2 T287D T288D complexed with pha-680632 | x-ray diffraction | A, B, C, D, E, F | — | — |
| 2C6D | Aurora A kinase activated mutant (T287D) in complex with ADPNP | x-ray diffraction | A | — | — |
| 2C6D | Aurora a kinase activated mutant (T287D) in complex with adpnp | x-ray diffraction | A | — | — |
| 2C6E | Aurora A kinase activated mutant (T287D) in complex with a 5- aminopyrimidinyl quinazoline inhibitor | x-ray diffraction | A, B | — | — |
| 2C6E | Aurora a kinase activated mutant (T287D) in complex with a 5-aminopyrimidinyl quinazoline inhibitor | x-ray diffraction | A, B | — | — |
| 2DWB | Aurora-A kinase complexed with AMPPNP | x-ray diffraction | A | — | — |
| 2DWB | Aurora-a kinase complexed with amppnp | x-ray diffraction | A | — | — |
| 2J4Z | Structure of Aurora-2 in complex with PHA-680626 | x-ray diffraction | A, B | — | — |
| 2J4Z | Structure of aurora-2 in complex with pha-680626 | x-ray diffraction | A, B | — | — |
| 2J50 | Structure of Aurora-2 in complex with PHA-739358 | x-ray diffraction | A, B | — | — |
| 2J50 | Structure of aurora-2 in complex with pha-739358 | x-ray diffraction | A, B | — | — |
| 2NP8 | Structural Basis for the Inhibition of Aurora A Kinase by a Novel Class of High Affinity… | x-ray diffraction | A | — | — |
| 2NP8 | Structural basis for the inhibition of aurora a kinase by a novel class of high affinity… | x-ray diffraction | A | — | — |
| 2W1C | Structure determination of Aurora Kinase in complex with inhibitor | x-ray diffraction | A | — | — |
| 2W1C | Structure determination of aurora kinase in complex with inhibitor | x-ray diffraction | A | — | — |
| 2W1D | Structure determination of Aurora Kinase in complex with inhibitor | x-ray diffraction | A | — | — |
| 2W1D | Structure determination of aurora kinase in complex with inhibitor | x-ray diffraction | A | — | — |
| 2W1E | Structure determination of Aurora Kinase in complex with inhibitor | x-ray diffraction | A | — | — |
| 2W1E | Structure determination of aurora kinase in complex with inhibitor | x-ray diffraction | A | — | — |
| 2W1F | Structure determination of Aurora Kinase in complex with inhibitor | x-ray diffraction | A | — | — |
| 2W1F | Structure determination of aurora kinase in complex with inhibitor | x-ray diffraction | A | — | — |
| 2W1G | Structure determination of Aurora Kinase in complex with inhibitor | x-ray diffraction | A | — | — |
| 2W1G | Structure determination of aurora kinase in complex with inhibitor | x-ray diffraction | A | — | — |
| 2WQE | Structure of S155R Aurora-A somatic mutant | x-ray diffraction | A | — | — |
| 2WQE | Structure of S155R aurora-a somatic mutant | x-ray diffraction | A | — | — |
| 2WTV | Aurora-A Inhibitor Structure | x-ray diffraction | A, B, C, D | — | — |
| 2WTV | Aurora-a inhibitor structure | x-ray diffraction | A, B, C, D | — | — |
| 2WTW | Aurora-A Inhibitor Structure (2nd crystal form) | x-ray diffraction | A | — | — |
| 2WTW | Aurora-a inhibitor structure (2ND crystal form) | x-ray diffraction | A | — | — |
| 2X6D | Aurora-A bound to an inhibitor | x-ray diffraction | A | — | — |
| 2X6D | Aurora-a bound to an inhibitor | x-ray diffraction | A | — | — |
| 2X6E | Aurora-A bound to an inhibitor | x-ray diffraction | A | — | — |
| 2X6E | Aurora-a bound to an inhibitor | x-ray diffraction | A | — | — |
| 2X81 | Structure of aurora a in complex with MLN8054 | x-ray diffraction | A | — | — |
| 2X81 | Structure of aurora a in complex with MLN8054 | x-ray diffraction | A | — | — |
| 2XNE | Structure of Aurora-A bound to an imidazopyrazine inhibitor | x-ray diffraction | A | — | — |
| 2XNE | Structure of aurora-a bound to an imidazopyrazine inhibitor | x-ray diffraction | A | — | — |
| 2XNG | Structure of Aurora-A bound to a selective imidazopyrazine inhibitor | x-ray diffraction | A | — | — |
| 2XNG | Structure of aurora-a bound to a selective imidazopyrazine inhibitor | x-ray diffraction | A | — | — |
| 2XRU | Aurora-a T288E complexed with pha-828300 | x-ray diffraction | A | — | — |
| 2XRU | Aurora-a T288E complexed with pha-828300 | x-ray diffraction | A | — | — |
| 3COH | Crystal structure of Aurora-A in complex with a pentacyclic inhibitor | x-ray diffraction | A, B | — | — |
| 3COH | Crystal structure of aurora-a in complex with a pentacyclic inhibitor | x-ray diffraction | A, B | — | — |
| 3E5A | Crystal structure of Aurora A in complex with VX-680 and TPX2 | x-ray diffraction | A | — | — |
| 3E5A | Crystal structure of aurora a in complex with vx-680 and TPX2 | x-ray diffraction | A | — | — |
| 3EFW | Structure of AuroraA with pyridyl-pyrimidine urea inhibitor | x-ray diffraction | A, B | — | — |
| 3EFW | Structure of auroraa with pyridyl-pyrimidine urea inhibitor | x-ray diffraction | A, B | — | — |
| 3FDN | Structure-based drug design of novel Aurora kinase A inhibitors: Structure basis for potency and… | x-ray diffraction | A | — | — |
| 3FDN | Structure-based drug design of novel aurora kinase a inhibitors: structure basis for potency and… | x-ray diffraction | A | — | — |
238 records more on the page itself.
Ligands
- MG · Magnesium ion · in 60 records
- ADP · Adenosine-5'-diphosphate · in 48 records
- CL · Chloride ion · in 26 records
- SO4 · Sulfate ion · in 22 records
- ANP · Phosphoaminophosphonic acid-adenylate ester · in 8 records
- ATP · Adenosine-5'-triphosphate · in 8 records
- ACP · Phosphomethylphosphonic acid adenylate ester · in 5 records
- SKE · 4-({5-amino-1-[(2,6-difluorophenyl)carbonyl]-1H-1,2,4-triazol-3-yl}amino)benzenesulfonamide · in 4 records
- 5DN · 2-(3-bromophenyl)-8-fluoroquinoline-4-carboxylic acid · in 3 records
- P4G · 1-ethoxy-2-(2-ethoxyethoxy)ethane · in 3 records
- T5L · (1~{R},2~{R})-cyclohexane-1,2-dicarboxylic acid · in 3 records
- 5E1 · 2-(3-bromophenyl)quinoline-4-carboxylic acid · in 2 records
- 627 · N-[(3E)-5-[(2R)-2-methoxy-2-phenylacetyl]pyrrolo[3,4-c]pyrazol-3(5H)-ylidene]-4-(4-methylpiperazin-1-yl)benzamide · in 2 records
- 9A6 · 7-(4-methylpiperazin-1-yl)-N-(5-methyl-1H-pyrazol-3-yl)-2-[(E)-2-phenylethenyl]quinazolin-4-amine · in 2 records
- 9YQ · 4-(propanoylamino)-~{N}-[4-[(5,8,11-trimethyl-6-oxidanylidene-pyrimido[4,5-b][1,4]benzodiazepin-2-yl)amino]phenyl]benzamide · in 2 records
- A5W · cyclobutyl-[4-(2-methoxyphenyl)piperidin-1-yl]methanone · in 2 records
- A65 · [3,5-bis(methylsulfanyl)-1,2-thiazol-4-yl]methanol · in 2 records
- A6W · methyl 3-azanyl-5-thiophen-2-yl-thiophene-2-carboxylate · in 2 records
- A6Z · 2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]ethanenitrile · in 2 records
- A98 · Methyl ~{N}-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl) carbamate · in 2 records
- AY4 · 2,4-bis(fluoranyl)-6-(1~{H}-pyrazol-3-yl)phenol · in 2 records
- EGJ · (2S,4R)-1-[(3-chloro-2-fluorophenyl)methyl]-2-methyl-4-({3-[(1,3-thiazol-2-yl)amino]isoquinolin-1-yl}methyl) piperidine-4-carboxylic acid · in 2 records
- G7W · (~{E})-~{N}-[4-(4-azanyl-1-propan-2-yl-pyrazolo[3,4-d]pyrimidin-3-yl)phenyl]-4-[4-fluoranyl-3-(trifluoromethyl)phenyl]-4-oxidanylidene-but-2-enamide · in 2 records
- GLC · alpha-D-glucopyranose · in 2 records
- JRT · 2-(benzimidazol-1-yl)-~{N}-(2-phenylethyl)ethanamide · in 2 records
- 35R · 1-cyclopropyl-3-{3-[5-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl}urea · in 1 record
- 4QV · 5-hydroxy-1'H-1,2'-bibenzimidazol-2(3H)-one · in 1 record
- 4RJ · 6-({4-[(Z)-{(2Z)-2-[(4-ethylphenyl)imino]-3-methyl-4-oxo-1,3-thiazolidin-5-ylidene}methyl]pyridin-2-yl}amino)pyridine-3-carboxylic acid · in 1 record
- 4RM · (2Z,5Z)-2-[(4-ethylphenyl)imino]-3-(2-methoxyethyl)-5-(pyridin-4-ylmethylidene)-1,3-thiazolidin-4-one · in 1 record
- 5E2 · 2-(3-bromophenyl)-6-chloroquinoline-4-carboxylic acid · in 1 record
Experiment against prediction
- 2XNG chain A against the predicted model O14965: TM-score 0.99, RMSD 0.58 Å
- 2XNG chain A against the predicted model O14965: TM-score 0.99, RMSD 0.58 Å
- 4ZS0 chain A against the predicted model O14965: TM-score 0.99, RMSD 0.61 Å
- 4ZS0 chain A against the predicted model O14965: TM-score 0.99, RMSD 0.61 Å
- 2W1G chain A against the predicted model O14965: TM-score 0.99, RMSD 0.64 Å
- 2W1G chain A against the predicted model O14965: TM-score 0.99, RMSD 0.64 Å
- 1OL6 chain A against the predicted model O14965: TM-score 0.99, RMSD 0.66 Å
- 1OL6 chain A against the predicted model O14965: TM-score 0.99, RMSD 0.66 Å
- 2W1F chain A against the predicted model O14965: TM-score 0.99, RMSD 0.66 Å
- 2W1F chain A against the predicted model O14965: TM-score 0.99, RMSD 0.66 Å
Elsewhere
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