9VZI

Cyanopodophage Pan3 Needle

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-03-10
Detector	DECTRIS PILATUS 200K
Wavelength(s)	1.54056
Spacegroup name	P 41 2 2
Unit cell lengths	71.403, 71.403, 172.706
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	13.020 - 2.600
R-factor	0.1828
Rwork	0.181
R-free	0.21990
Structure solution method	SAD
RMSD bond length	0.008
RMSD bond angle	0.983
Data reduction software	CrysalisPro
Data scaling software	CrysalisPro
Phasing software	CRANK2
Refinement software	PHENIX ((1.20.1_4487: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	13.020	2.730
High resolution limit [Å]	2.600	2.600
Number of reflections	14321	1877
<I/σ(I)>	26.7	9.2
Completeness [%]	99.2	100
Redundancy	16.5	12
CC(1/2)	0.998	0.978

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	0.1 M HEPES pH 7.0 1.5 M ammonium sulfate