Experiment: 1RGF

X-RAY DIFFRACTION

Crystalization Experiments
ID	Method	pH	Temperature	Details
1		6.7		ROOM TEMPERATURE, PH 6.7, AMMONIUM SULFATE

Crystal Properties
Matthews coefficient	Solvent content
2.35	47.6

Symmetry
Space Group	P 21 21 21

Diffraction Experiment
ID #	Crystal ID	Scattering Type	Data Collection Temperature	Detector	Detector Type	Details	Collection Date	Monochromator	Protocol
1	1	x-ray		IMAGE PLATE	MARRESEARCH		1993-11-22	M

Radiation Source
ID #	Source	Type	Wavelength List	Synchrotron Site	Beamline
1	SYNCHROTRON	EMBL/DESY, HAMBURG BEAMLINE X11		EMBL/DESY, HAMBURG	X11

Statistics
Diffraction ID	Structure Solution Method	Resolution (High)	Resolution (Low)	Number Reflections (Observed)	Number Reflections (R-Free)	Percent Reflections (Observed)	R-Work	R-Free	Mean Isotropic B
X-RAY DIFFRACTION		1.2	10	57561		95

Temperature Factor Modeling
Anisotropic B[1][1]	Anisotropic B[1][2]	Anisotropic B[1][3]	Anisotropic B[2][2]	Anisotropic B[2][3]	Anisotropic B[3][3]

RMS Deviations
Key	Refinement Restraint Deviation
p_staggered_tor	15
p_transverse_tor	12.6
p_scangle_it	9
p_scbond_it	6.5
p_planar_tor	3.7
p_mcangle_it	3.3
p_mcbond_it	2.2
p_multtor_nbd	0.275
p_xyhbond_nbd	0.27
p_singtor_nbd	0.17

RMS Deviations
Key	Refinement Restraint Deviation
p_staggered_tor	15
p_transverse_tor	12.6
p_scangle_it	9
p_scbond_it	6.5
p_planar_tor	3.7
p_mcangle_it	3.3
p_mcbond_it	2.2
p_multtor_nbd	0.275
p_xyhbond_nbd	0.27
p_singtor_nbd	0.17
p_chiral_restr	0.149
p_planar_d	0.041
p_angle_d	0.038
p_bond_d	0.021
p_plane_restr	0.018
p_angle_deg
p_hb_or_metal_coord
p_xhyhbond_nbd
p_orthonormal_tor
p_special_tor