7U1J

Crystal structure of Pisum sativum convicilin

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CLSI BEAMLINE 08B1-1
Synchrotron site	CLSI
Beamline	08B1-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-08-17
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.98
Spacegroup name	F 2 3
Unit cell lengths	269.155, 269.155, 269.155
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	134.941 - 2.701
Rwork	0.215
R-free	0.28100
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1uik
RMSD bond length	0.009
RMSD bond angle	1.768
Data reduction software	DIALS
Data scaling software	DIALS
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	134.941	2.810
High resolution limit [Å]	2.700	2.700
Rmerge	0.127	0.554
Rmeas	0.151	0.663
Rpim	0.081	0.359
Number of reflections	44137	4997
<I/σ(I)>	8.9
Completeness [%]	99.8
Redundancy	5.5	5.7
CC(1/2)	0.995	0.811

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6	293	0.15M Ammonium Acetate, 25% PEG3350, 0.05M Bis Tris