Crystal structure of bovine Cu, Zn SOD to 1.7 Angstrom (3 of 3)

entry_id	1e9p
deposition_date	2000-10-25
title	Crystal structure of bovine Cu, Zn SOD to 1.7 Angstrom (3 of 3)
keywords	OXIDOREDUCTASE, SOD, ENZYME, SUPEROXIDE, ASYMMETRY; OXIDOREDUCTASE
method	X-RAY DIFFRACTION

rg_guinier	20.90 Å
rg_electron	19.95 Å
i0	19484300.00
molecular_weight	30720.0 kDa
excluded_volume	37229 ų
envelope_volume	44050 ų
shell_volume	19030 ų
envelope_diameter	72.2 Å
shell_rg	25.69 Å
envelope_rg	20.16 Å
shape_rg	19.98 Å
total_rg	20.61 Å
total_atoms	2144
n_residues	302
n_harmonics	20
q_range	— – 0.5000 Å−1
n_points	101
shell_type	directional
solvent_density	0.3340 e/ų
contrast_shell	0.0300 e/ų
crysol_version	4.1.3

dmax	71.7 Å
rg_real	20.93 Å
rg_real_error	0.59 Å
i0_real	1.9480e+07
i0_real_error	2.4370e+05
rg_reciprocal	20.93 Å
i0_reciprocal	19480000.0000
total_estimate	0.8703
solution_quality	GOOD a GOOD solution
n_peaks	2
r_peak_primary	22.8 Å
skewness	0.391
kurtosis	-0.357
angular_range	— – 0.3800 Å−1
current_alpha	0.0000
highest_alpha	2657000.0000
n_real_points	70
gnom_version	4.1.3
quality_criteria	AN1: 0.000; Oscil: 0.792; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.939; Smooth: 0.994

Unit Cell

length_a	47.800 Å
length_b	51.100 Å
length_c	148.000 Å
angle_alpha	90.00 °
angle_beta	90.00 °
angle_gamma	90.00 °
z_pdb	4

Symmetry

space_group	P 21 21 21
int_tables_number	19
crystal_system	—

Refinement

resolution	1.700 Å
resolution_low	75.000 Å
r_factor	—
r_work	0.1850
r_free	0.2020

Diffraction

temperature

287.0 K

Files (7)

• pr_distribution /app/data/pr_computation/e9/1e9p/pr_distribution.json
• pr_output /app/data/pr_computation/e9/1e9p/1e9p.pr.out
• pr_plot /app/data/visualization/pr_computation/e9/1e9p/1e9p_pr_distribution.png
• saxs_curve_dat /app/data/saxs_computation/e9/1e9p/1e9p.dat
• saxs_fit /app/data/saxs_computation/e9/1e9p/1e9p.fit
• saxs_log /app/data/saxs_computation/e9/1e9p/1e9p.log
• saxs_plot /app/data/visualization/saxs_computation/e9/1e9p/1e9p_saxs_profile.png

Curves (3)

fit	/app/data/saxs_computation/e9/1e9p/1e9p.fit
pddf	/app/data/pr_computation/e9/1e9p/1e9p.pr.out
profile	/app/data/saxs_computation/e9/1e9p/1e9p.dat