2WXV

Structure of CDK2-CYCLIN A with a Pyrazolo(4,3-h) quinazoline-3- carboxamide inhibitor

Summary for 2WXV

Related1H08 1PYE 2VTH 1V1K 2B53 1KE7 1OKV 1H25 1PXK 2WIH 2BHH 2VTA 2UUE 1E1V 1GZ8 1OL2 1H27 1JSV 2B52 2WHA 1KE5 1FIN 2C5O 2C68 1P2A 2VTT 2VTQ 2C4G 1H1Q 1W0X 1PXO 2W05 1KE9 2A0C 1HCK 1JSU 1PXN 2UZE 2V0D 2VTM 1OIQ 1H1R 2IW8 1GIH 1PW2 1HCL 2WHB 2W06 2VTN 1JST 1OIU 1PXM 1B38 1FQ1 1VYW 1H1P 2WMA 2C69 1URC 1PXI 2C6I 1YKR 2W17 2C5Y 2C6K 2UZD 1WCC 2J9M 1VYZ 2VTI 1JVP 1W98 1PKD 2WIP 1P5E 2VTS 2C5P 2UZN 2B54 1KE6 1PXJ 2UZL 2CCI 2BKZ 2G9X 1Y91 2IW6 1GIJ 1R78 1H0V 2IW9 1W8C 1BUH 2BPM 2BTS 1FVV 1OKW 2VTP 2A4L 2C6T 1FVT 1QMZ 2W1H 2VU3 1OGU 2B55 1PF8 1H1S 2JGZ 2C5V 2BHE 1URW 1OIY 2C6L 1F5Q 2C6O 2VTL 1OL1 2UZB 2WFY 1H01 1OIR 1OI9 2VTJ 2CJM 2WEV 2C5N 2C5X 2C6M 1OIT 2V22 1GY3 1DI8 2VV9 1GII 2WPA 2WMB 1E9H 2VTO 1DM2 1H24 2UZO 1H00 2EXM 2CLX 1PXP 2CCH 2BTR 1B39 1AQ1 1H0W 1CKP 1G5S 1KE8 1PXL 1H28 2VTR 1H26 1E1X 1H07 1Y8Y
DescriptorCELL DIVISION PROTEIN KINASE 2, CYCLIN-A2, N,1-DIMETHYL-8-{[1-(METHYLSULFONYL)PIPERIDIN-4-YL]AMINO}-1H-PYRAZOLO[4,3-H]QUINAZOLINE-3-CARBOXAMIDE, ... (5 entities in total)
Functional Keywordsnucleotide-binding, serine/threonine-protein kinase, cell cycle, transferase, kinase, cyclin
Biological sourceHOMO SAPIENS (HUMAN)
Total number of polymer chains4
Total molecular weight131992.73
Authors
Primary citation
Traquandi, G.,Ciomei, M.,Ballinari, D.,Casale, E.,Colombo, N.,Croci, V.,Fiorentini, F.,Isacchi, A.,Longo, A.,Mercurio, C.,Panzeri, A.,Pastori, W.,Pevarello, P.,Volpi, D.,Roussel, P.,Vulpetti, A.,Brasca, M.G.
Identification of Potent Pyrazolo[4,3-H]Quinazoline-3-Carboxamides as Multi-Cyclin-Dependent Kinase Inhibitors.
J.Med.Chem., 53:2171-, 2010
PubMed: 20141146 (PDB entries with the same primary citation)
DOI: 10.1021/JM901710H
MImport into Mendeley
Experimental method
X-RAY DIFFRACTION (2.6 Å)
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Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers 0.21112 0.2% 3.7% 1.4%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution

More Asymmetric unit images

Molmil generated image of 2wxv
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Molmil generated image of 2wxv
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Molmil generated image of 2wxv
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More Biological unit images

Molmil generated image of 2wxv
no rotation
Molmil generated image of 2wxv
rotated about x axis by 90°
Molmil generated image of 2wxv
rotated about y axis by 90°
(*)In the case of coarse surface representation, the asymmetric unit is shown as red ribbon representation.
Coordinate files for Biological unit (2wxv.pdb2.gz [95.46 KB])
Coordinate files for Biological unit (2wxv.pdb1.gz [95.64 KB])