Author results

1H0V
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HUMAN CYCLIN DEPENDENT PROTEIN KINASE 2 IN COMPLEX WITH THE INHIBITOR 2-AMINO-6-[(R)-PYRROLIDINO-5'-YL]METHOXYPURINE
Descriptor:CELL DIVISION PROTEIN KINASE 2, 5-{[(2-AMINO-9H-PURIN-6-YL)OXY]METHYL}-2-PYRROLIDINONE
Authors:Gibson, A.E., Arris, C.E., Bentley, J., Boyle, F.T., Curtin, N.J., Davies, T.G., Endicott, J.A., Golding, B.T., Grant, S., Griffin, R.J., Jewsbury, P., Johnson, L.N., Mesguiche, V., Newell, D.R., Noble, M.E.M., Tucker, J.A., Whitfield, H.J.
Deposit date:2002-06-27
Release date:2003-06-27
Last modified:2019-03-06
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Probing the ATP Ribose-Binding Domain of Cyclin-Dependent Kinases 1 and 2 with O(6)-Substituted Guanine Derivatives
J.Med.Chem., 45, 2002
1H0W
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HUMAN CYCLIN DEPENDENT PROTEIN KINASE 2 IN COMPLEX WITH THE INHIBITOR 2-AMINO-6-[CYCLOHEX-3-ENYL]METHOXYPURINE
Descriptor:CELL DIVISION PROTEIN KINASE 2, 1-AMINO-6-CYCLOHEX-3-ENYLMETHYLOXYPURINE
Authors:Gibson, A.E., Arris, C.E., Bentley, J., Boyle, F.T., Curtin, N.J., Davies, T.G., Endicott, J.A., Golding, B.T., Grant, S., Griffin, R.J., Jewsbury, P., Johnson, L.N., Mesguiche, V., Newell, D.R., Noble, M.E.M., Tucker, J.A., Whitfield, H.J.
Deposit date:2002-06-27
Release date:2003-06-27
Last modified:2019-03-06
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Probing the ATP Ribose-Binding Domain of Cyclin-Dependent Kinases 1 and 2 with O(6)-Substituted Guanine Derivatives
J.Med.Chem., 45, 2002
2IW6
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STRUCTURE OF HUMAN THR160-PHOSPHO CDK2-CYCLIN A COMPLEXED WITH A BISANILINOPYRIMIDINE INHIBITOR
Descriptor:CELL DIVISION PROTEIN KINASE 2, CYCLIN-A2, [(2-CHLORO-5-METHYLPHENYL){6-[(4-{[(2R)-3-(DIMETHYLAMINO)-2-HYDROXYPROPYL]OXY}PHENYL)AMINO]PYRIMIDIN-4-YL}AMINO]ACETONITRILE, ...
Authors:Pratt, D.J., Bentley, J., Jewsbury, P., Boyle, F.T., Endicott, J.A., Noble, M.E.M.
Deposit date:2006-06-26
Release date:2006-09-06
Last modified:2012-11-14
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Dissecting the Determinants of Cyclin-Dependent Kinase 2 and Cyclin-Dependent Kinase 4 Inhibitor Selectivity.
J.Med.Chem., 49, 2006
2IW8
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STRUCTURE OF HUMAN THR160-PHOSPHO CDK2-CYCLIN A F82H-L83V-H84D MUTANT WITH AN O6-CYCLOHEXYLMETHYLGUANINE INHIBITOR
Descriptor:CELL DIVISION PROTEIN KINASE 2, CYCLIN-A2, O6-CYCLOHEXYLMETHOXY-2-(4'-SULPHAMOYLANILINO) PURINE, ...
Authors:Pratt, D.J., Bentley, J., Jewsbury, P., Boyle, F.T., Endicott, J.A., Noble, M.E.M.
Deposit date:2006-06-27
Release date:2006-09-06
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Dissecting the Determinants of Cyclin-Dependent Kinase 2 and Cyclin-Dependent Kinase 4 Inhibitor Selectivity.
J.Med.Chem., 49, 2006
2IW9
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STRUCTURE OF HUMAN THR160-PHOSPHO CDK2-CYCLIN A COMPLEXED WITH A BISANILINOPYRIMIDINE INHIBITOR
Descriptor:CELL DIVISION PROTEIN KINASE 2, CYCLIN-A2, O6-CYCLOHEXYLMETHOXY-2-(4'-SULPHAMOYLANILINO) PURINE, ...
Authors:Pratt, D.J., Bentley, J., Jewsbury, P., Boyle, F.T., Endicott, J.A., Noble, M.E.M.
Deposit date:2006-06-27
Release date:2006-09-06
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2 Å)
Cite:Dissecting the Determinants of Cyclin-Dependent Kinase 2 and Cyclin-Dependent Kinase 4 Inhibitor Selectivity.
J.Med.Chem., 49, 2006
1GZ8
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HUMAN CYCLIN DEPENDENT KINASE 2 COMPLEXED WITH THE INHIBITOR 2-AMINO-6-(3'-METHYL-2'-OXO)BUTOXYPURINE
Descriptor:CELL DIVISION PROTEIN KINASE 2, 1-[(2-AMINO-6,9-DIHYDRO-1H-PURIN-6-YL)OXY]-3-METHYL-2-BUTANOL
Authors:Davies, T., Endicott, J., Johnson, L., Noble, M., Tucker, J.
Deposit date:2002-05-17
Release date:2003-06-12
Last modified:2019-03-06
Method:X-RAY DIFFRACTION (1.3 Å)
Cite:Probing the ATP Ribose-Binding Domain of Cyclin-Dependent Kinases 1 and 2 with O(6)-Substituted Guanine Derivatives
J.Med.Chem., 45, 2002
4V00
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STRUCTURAL AND FUNCTIONAL CHARACTERIZATION OF A NOVEL MONOTREME- SPECIFIC PROTEIN FROM THE MILK OF THE PLATYPUS
Descriptor:MONOTREME LACTATING PROTEIN, N-ACETYL-D-GLUCOSAMINE, GLYCEROL
Authors:Enjapoori, A.K., Newman, J., Polekina, G., Adams, T.E., Sharp, J.A., Peat, T.S., Nicholas, K.R.
Deposit date:2014-09-10
Release date:2015-09-30
Last modified:2019-05-15
Method:X-RAY DIFFRACTION (1.82 Å)
Cite:Structural characterization of a novel monotreme-specific protein with antimicrobial activity from the milk of the platypus.
Acta Crystallogr F Struct Biol Commun, 74, 2018
4V3J
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STRUCTURAL AND FUNCTIONAL CHARACTERIZATION OF A NOVEL MONOTREME- SPECIFIC PROTEIN FROM THE MILK OF THE PLATYPUS
Descriptor:MONOTREME LACTATING PROTEIN, N-ACETYL-D-GLUCOSAMINE
Authors:Kumar, A., Newman, J., Polekina, G., Adams, T.E., Sharp, J.A., Peat, T.S., Nicholas, K.R.
Deposit date:2014-10-20
Release date:2016-01-20
Last modified:2019-05-15
Method:X-RAY DIFFRACTION (1.97 Å)
Cite:Structural characterization of a novel monotreme-specific protein with antimicrobial activity from the milk of the platypus.
Acta Crystallogr F Struct Biol Commun, 74, 2018
6B4M
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STRUCTURAL CHARACTERIZATION OF A NOVEL MONOTREME-SPECIFIC PROTEIN FROM THE MILK OF THE PLATYPUS
Descriptor:Monotreme lactation protein, N-ACETYL-D-GLUCOSAMINE, IODIDE ION, ...
Authors:Peat, T.S., Newman, J., Sharp, J.A., Kumar, A., Nicholas, K.R., Adams, T.E.
Deposit date:2017-09-27
Release date:2018-01-17
Last modified:2018-05-16
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structural characterization of a novel monotreme-specific protein with antimicrobial activity from the milk of the platypus.
Acta Crystallogr F Struct Biol Commun, 74, 2018
6BA2
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CRYSTAL STRUCTURE OF MYST ACETYLTRANSFERASE DOMAIN IN COMPLEX WITH INHIBITOR
Descriptor:Histone acetyltransferase KAT8, CHLORIDE ION, ZINC ION, ...
Authors:Hermans, S.J., Chung, M.C., Peat, T.S., Baell, J.B., Thomas, T., Parker, M.W.
Deposit date:2017-10-11
Release date:2018-08-01
Last modified:2020-01-08
Method:X-RAY DIFFRACTION (1.850038 Å)
Cite:Inhibitors of histone acetyltransferases KAT6A/B induce senescence and arrest tumour growth.
Nature, 560, 2018
6BA4
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CRYSTAL STRUCTURE OF MYST ACETYLTRANSFERASE DOMAIN IN COMPLEX WITH ACETYL-COA COFACTOR
Descriptor:Histone acetyltransferase KAT8, ZINC ION, SODIUM ION, ...
Authors:Hermans, S.J., Chung, M.C., Peat, T.S., Baell, J.B., Thomas, T., Parker, M.W.
Deposit date:2017-10-12
Release date:2018-08-01
Last modified:2020-01-08
Method:X-RAY DIFFRACTION (1.949 Å)
Cite:Inhibitors of histone acetyltransferases KAT6A/B induce senescence and arrest tumour growth.
Nature, 560, 2018
6CT2
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MYST HISTONE ACETYLTRANSFERASE KAT6A/B IN COMPLEX WITH WM-1119
Descriptor:Histone acetyltransferase KAT8, 3-fluoro-N'-[(2-fluorophenyl)sulfonyl]-5-(pyridin-2-yl)benzohydrazide, ZINC ION, ...
Authors:Ren, B., Peat, T.S.
Deposit date:2018-03-22
Release date:2018-08-01
Last modified:2018-08-22
Method:X-RAY DIFFRACTION (2.128 Å)
Cite:Inhibitors of histone acetyltransferases KAT6A/B induce senescence and arrest tumour growth.
Nature, 560, 2018
1OI9
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STRUCTURE OF HUMAN THR160-PHOSPHO CDK2/CYCLIN A COMPLEXED WITH A 6-CYCLOHEXYLMETHYLOXY-2-ANILINO-PURINE INHIBITOR
Descriptor:CELL DIVISION PROTEIN KINASE 2, CYCLIN A2, 6-CYCLOHEXYLMETHYLOXY-2-(4'-HYDROXYANILINO)PURINE, ...
Authors:Pratt, D.J., Endicott, J.A., Noble, M.E.M.
Deposit date:2003-06-10
Release date:2004-07-13
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:N2-Substituted O6-Cyclohexylmethylguanine Derivatives: Potent Inhibitors of Cyclin-Dependent Kinases 1 and 2
J.Med.Chem., 47, 2004
1OIU
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STRUCTURE OF HUMAN THR160-PHOSPHO CDK2/CYCLIN A COMPLEXED WITH A 6-CYCLOHEXYLMETHYLOXY-2-ANILINO-PURINE INHIBITOR
Descriptor:CELL DIVISION PROTEIN KINASE 2, CYCLIN A2, 3-(6-CYCLOHEXYLMETHOXY-9H-PURIN-2-YLAMINO)-BENZENESULFONAMIDE, ...
Authors:Pratt, D.J., Endicott, J.A., Noble, M.E.M.
Deposit date:2003-06-26
Release date:2004-07-13
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2 Å)
Cite:N2-Substituted O6-Cyclohexylmethylguanine Derivatives: Potent Inhibitors of Cyclin-Dependent Kinases 1 and 2
J.Med.Chem., 47, 2004
1OIY
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STRUCTURE OF HUMAN THR160-PHOSPHO CDK2/CYCLIN A COMPLEXED WITH A 6-CYCLOHEXYLMETHYLOXY-2-ANILINO-PURINE INHIBITOR
Descriptor:CELL DIVISION PROTEIN KINASE 2, CYCLIN A2, 4-(6-CYCLOHEXYLMETHOXY-9H-PURIN-2-YLAMINO)--BENZAMIDE, ...
Authors:Pratt, D.J., Endicott, J.A., Noble, M.E.M.
Deposit date:2003-06-26
Release date:2004-07-13
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:N2-Substituted O6-Cyclohexylmethylguanine Derivatives: Potent Inhibitors of Cyclin-Dependent Kinases 1 and 2
J.Med.Chem., 47, 2004
6PG3
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WDR5DELTA23 BOUND TO (2-BUTYL-1H-IMIDAZOL-4-YL)METHANOL
Descriptor:WD repeat-containing protein 5, (2-butyl-1H-imidazol-4-yl)methanol
Authors:Dennis, M.L., Peat, T.S.
Deposit date:2019-06-24
Release date:2019-12-11
Method:X-RAY DIFFRACTION (2.04 Å)
Cite:Fragment screening for a protein-protein interaction inhibitor to WDR5.
Struct Dyn., 6, 2019
6PG4
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WDR5DELTA32 BOUND TO (2-METHYL-1H-IMIDAZOL-4-YL)METHANOL
Descriptor:WD repeat-containing protein 5, (2-methyl-1H-imidazol-4-yl)methanol, SULFATE ION
Authors:Dennis, M.L., Peat, T.S.
Deposit date:2019-06-24
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Fragment screening for a protein-protein interaction inhibitor to WDR5.
Struct Dyn., 6, 2019
6PG5
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WDR5DELTA32 BOUND TO BENZYL (4-(5-(HYDROXYMETHYL)-1H-IMIDAZOL-2-YL)BUTYL)CARBAMATE
Descriptor:WD repeat-containing protein 5, benzyl {4-[5-(hydroxymethyl)-1H-imidazol-2-yl]butyl}carbamate, SULFATE ION
Authors:Dennis, M.L., Peat, T.S.
Deposit date:2019-06-24
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.99 Å)
Cite:Fragment screening for a protein-protein interaction inhibitor to WDR5.
Struct Dyn., 6, 2019
6PG6
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WDR5DELTA23 BOUND TO N-(4-(5-(HYDROXYMETHYL)-1H-IMIDAZOL-2-YL)BUTYL)ACETAMIDE
Descriptor:WD repeat-containing protein 5, SULFATE ION, N-{4-[4-(hydroxymethyl)-1H-imidazol-2-yl]butyl}acetamide, ...
Authors:Dennis, M.L., Peat, T.S.
Deposit date:2019-06-24
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.68 Å)
Cite:Fragment screening for a protein-protein interaction inhibitor to WDR5.
Struct Dyn., 6, 2019
6PG7
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WDR5DELTA32 BOUND TO (2-(3-METHOXY-3-PHENYLPROPYL)-1H-IMIDAZOL-4-YL)METHANOL
Descriptor:WD repeat-containing protein 5, {2-[(3S)-3-methoxy-3-phenylpropyl]-1H-imidazol-4-yl}methanol, DI(HYDROXYETHYL)ETHER
Authors:Dennis, M.L., Peat, T.S.
Deposit date:2019-06-24
Release date:2019-12-11
Method:X-RAY DIFFRACTION (2.45 Å)
Cite:Fragment screening for a protein-protein interaction inhibitor to WDR5.
Struct Dyn., 6, 2019
6PG8
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WDR5DELTA23 BOUND TO (2-(3-PHENYLPROPYL)-1H-IMIDAZOL-4-YL)METHANOL
Descriptor:WD repeat-containing protein 5, [2-(3-phenylpropyl)-1H-imidazol-4-yl]methanol, CHLORIDE ION, ...
Authors:Dennis, M.L., Peat, T.S.
Deposit date:2019-06-24
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.67 Å)
Cite:Fragment screening for a protein-protein interaction inhibitor to WDR5.
Struct Dyn., 6, 2019
6PG9
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WDR5DELTA23 BOUND TO N-(4-(5-(HYDROXYMETHYL)-1H-IMIDAZOL-2-YL)BUTYL)BENZAMIDE
Descriptor:WD repeat-containing protein 5, N-{4-[4-(hydroxymethyl)-1H-imidazol-2-yl]butyl}benzamide
Authors:Dennis, M.L., Peat, T.S.
Deposit date:2019-06-24
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Fragment screening for a protein-protein interaction inhibitor to WDR5.
Struct Dyn., 6, 2019
6PGA
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WDR5DELTA32 BOUND TO METHYL (4-(4-(HYDROXYMETHYL)-1H-IMIDAZOL-2-YL)BUTYL)CARBAMATE
Descriptor:WD repeat-containing protein 5, methyl {4-[5-(hydroxymethyl)-1H-imidazol-2-yl]butyl}carbamate, SULFATE ION
Authors:Dennis, M.L., Peat, T.S.
Deposit date:2019-06-24
Release date:2019-12-11
Method:X-RAY DIFFRACTION (2.45 Å)
Cite:Fragment screening for a protein-protein interaction inhibitor to WDR5.
Struct Dyn., 6, 2019
6PGB
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WDR5DELTA32 BOUND TO N-(4-(5-(HYDROXYMETHYL)-1H-IMIDAZOL-2-YL)BUTYL)-2-PHENYLACETAMIDE
Descriptor:WD repeat-containing protein 5, N-{4-[5-(hydroxymethyl)-1H-imidazol-2-yl]butyl}-2-phenylacetamide, SULFATE ION
Authors:Dennis, M.L., Peat, T.S.
Deposit date:2019-06-24
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.73 Å)
Cite:Fragment screening for a protein-protein interaction inhibitor to WDR5.
Struct Dyn., 6, 2019
6PGC
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WDR5DELTA32 BOUND TO METHYL BENZYL(4-(4-(HYDROXYMETHYL)-1H-IMIDAZOL-2-YL)BUTYL)CARBAMATE
Descriptor:WD repeat-containing protein 5, SULFATE ION, methyl benzyl{4-[4-(hydroxymethyl)-1H-imidazol-2-yl]butyl}carbamate
Authors:Dennis, M.L., Peat, T.S.
Deposit date:2019-06-24
Release date:2019-12-11
Method:X-RAY DIFFRACTION (1.81 Å)
Cite:Fragment screening for a protein-protein interaction inhibitor to WDR5.
Struct Dyn., 6, 2019
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