1MBC

X-RAY DIFFRACTION

Crystal Properties
Matthews coefficient	Solvent content
1.92	35.8

Symmetry
Space Group	P 1 21 1

Diffraction Experiment
ID #	Crystal ID	Scattering Type	Data Collection Temperature	Detector	Detector Type	Details	Collection Date	Monochromator	Protocol
1	1	x-ray

Statistics
Diffraction ID	Structure Solution Method	Resolution (High)	Resolution (Low)	Number Reflections (R-Free)	Percent Reflections (Observed)	R-Factor (Observed)	R-Work	R-Free	Mean Isotropic B
X-RAY DIFFRACTION		1.5				0.171

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_orthonormal_tor	34
p_staggered_tor	20
p_planar_tor	6.2
p_scangle_it	1.9
p_mcangle_it	1.1
p_scbond_it	1.1
p_mcbond_it	0.9
p_chiral_restr	0.17
p_planar_d	0.057
p_angle_d	0.047

RMS Deviations
Key	Refinement Restraint Deviation
p_orthonormal_tor	34
p_staggered_tor	20
p_planar_tor	6.2
p_scangle_it	1.9
p_mcangle_it	1.1
p_scbond_it	1.1
p_mcbond_it	0.9
p_chiral_restr	0.17
p_planar_d	0.057
p_angle_d	0.047
p_bond_d	0.03
p_plane_restr	0.016
p_angle_deg
p_hb_or_metal_coord
p_singtor_nbd
p_multtor_nbd
p_xhyhbond_nbd
p_xyhbond_nbd
p_transverse_tor
p_special_tor