4YMY

Crystal structure of mutant nitrobindin M75A/H76L/Q96C/M148L/H158A (NB11) from Arabidopsis thaliana

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL44XU
Synchrotron site	SPring-8
Beamline	BL44XU
Temperature [K]	100
Detector technology	CCD
Collection date	2014-05-18
Detector	RAYONIX MX300HE
Wavelength(s)	0.90000
Spacegroup name	P 21 21 2
Unit cell lengths	59.654, 79.285, 36.409
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.670 - 1.000
R-factor	0.12375
Rwork	0.123
R-free	0.13593
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2a13
RMSD bond length	0.023
RMSD bond angle	2.020
Data reduction software	HKL-2000
Phasing software	PHASER
Refinement software	REFMAC (5.8.0049)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.040
High resolution limit [Å]	1.000	1.000
Number of reflections	92122
<I/σ(I)>	42.7	4.2
Completeness [%]	98.3	95.7
Redundancy	10.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.3	293	Tris-HCl buffer, polyethylene glycol 2000