5JCB

Microtubule depolymerizing agent podophyllotoxin derivative YJTSF1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U
Synchrotron site	SSRF
Beamline	BL17U
Temperature [K]	100
Detector technology	CCD
Collection date	2015-01-10
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.9795
Spacegroup name	P 21 21 21
Unit cell lengths	104.357, 157.252, 179.631
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.636 - 2.300
R-factor	0.1822
Rwork	0.181
R-free	0.19990
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4i4t
RMSD bond length	0.008
RMSD bond angle	1.035
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((1.10.1_2155))

Data quality characteristics

	Overall
Low resolution limit [Å]	50.000
High resolution limit [Å]	2.300
Number of reflections	131984
<I/σ(I)>	11.6
Completeness [%]	99.9
Redundancy	7.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	PEG 4000, Glycerol, Magnesium chloride, Calcium chloride