5YM7

Crystal Structure of B562RIL without disulfide bond

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U1
Synchrotron site	SSRF
Beamline	BL17U1
Temperature [K]	100
Detector technology	CCD
Collection date	2017-05-17
Detector	MAR CCD 130 mm
Wavelength(s)	0.9793
Spacegroup name	C 2 2 21
Unit cell lengths	41.847, 51.155, 89.950
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	44.975 - 1.562
R-factor	0.201049806393
Rwork	0.197
R-free	0.23844
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1m6t
RMSD bond length	0.002
RMSD bond angle	0.459
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.10_2155)

Data quality characteristics

	Overall
Low resolution limit [Å]	44.975
High resolution limit [Å]	1.562
Number of reflections	14000
<I/σ(I)>	39.06
Completeness [%]	100.0
Redundancy	6.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		292	NH4(SO4), Bicine , N-octanoylsucrose