7CBU

Blasnase-T13A with L-Asp

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL18U1
Synchrotron site	SSRF
Beamline	BL18U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-10-01
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9791
Spacegroup name	P 41 21 2
Unit cell lengths	92.651, 92.651, 234.096
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.925 - 2.250
Rwork	0.196
R-free	0.21690
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7c91
RMSD bond length	0.014
RMSD bond angle	1.702
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	REFMAC (5.8.0258)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	19.925	2.320
High resolution limit [Å]	2.250	2.250
Rpim	0.041	0.408
Number of reflections	49335	4447
<I/σ(I)>	12.3	1.9
Completeness [%]	99.9
Redundancy	24.6
CC(1/2)	0.999	0.724

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		295	formate