2AAY

EPSP synthase liganded with shikimate and glyphosate

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU RU300
Temperature [K]	90
Detector technology	IMAGE PLATE
Collection date	2005-02-26
Detector	RIGAKU RAXIS IV
Wavelength(s)	1.5418
Spacegroup name	P 21 21 21
Unit cell lengths	57.678, 84.916, 87.542
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	15.000 - 1.550
R-factor	0.156
Rwork	0.156
R-free	0.18800
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1g6s
RMSD bond length	0.011
RMSD bond angle	1.590
Data reduction software	XDS
Data scaling software	XDS
Phasing software	CNS
Refinement software	CNS

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	15.000	1.600
High resolution limit [Å]	1.550	1.550
Rmerge	0.049	0.153
Number of reflections	62861
<I/σ(I)>	20	6.6
Completeness [%]	99.7	97.4
Redundancy	6.6	5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	290	Na formate, pH 7, VAPOR DIFFUSION, HANGING DROP, temperature 290K