STRUCTURE OF PORCINE TRYPSIN COMPLEXED WITH BDELLASTASIN, AN ANTISTASIN-TYPE INHIBITOR

entry_id	1eja
deposition_date	2000-03-02
title	STRUCTURE OF PORCINE TRYPSIN COMPLEXED WITH BDELLASTASIN, AN ANTISTASIN-TYPE INHIBITOR
keywords	Complex (Hydrolase-Inhibitor), Hydrolase, Inhibitor, Bdellastasin, Antistasin, Trypsin, HYDROLASE-INHIBITOR complex; HYDROLASE/INHIBITOR
method	X-RAY DIFFRACTION

rg_guinier	18.98 Å
rg_electron	17.94 Å
i0	16681800.00
molecular_weight	29142.0 kDa
excluded_volume	35773 ų
envelope_volume	41219 ų
shell_volume	19054 ų
envelope_diameter	63.1 Å
shell_rg	24.43 Å
envelope_rg	18.29 Å
shape_rg	17.92 Å
total_rg	18.90 Å
total_atoms	2027
n_residues	276
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	61.7 Å
rg_real	18.89 Å
rg_real_error	0.39 Å
i0_real	1.6680e+07
i0_real_error	1.9520e+05
rg_reciprocal	18.90 Å
i0_reciprocal	16680000.0000
total_estimate	0.8072
solution_quality	GOOD a GOOD solution
n_peaks	3
r_peak_primary	24.0 Å
skewness	0.237
kurtosis	-0.287
angular_range	— – 0.4200 Å−1
current_alpha	0.0000
highest_alpha	3575000.0000
n_real_points	73
gnom_version	4.1.3
quality_criteria	AN1: 0.000; Oscil: 0.831; Stabil: 0.999; Sysdev: 1.000; Positv: 1.000; Valcen: 0.999; Smooth: 0.000

Unit Cell

length_a	70.020 Å
length_b	70.020 Å
length_c	119.480 Å
angle_alpha	90.00 °
angle_beta	90.00 °
angle_gamma	90.00 °
z_pdb	8

Symmetry

space_group	P 41 21 2
int_tables_number	92
crystal_system	—

Refinement

resolution	2.700 Å
resolution_low	8.000 Å
r_factor	—
r_work	0.1910
r_free	0.2480

Diffraction

temperature

277.0 K

Files (7)

• pr_distribution /app/data/pr_computation/ej/1eja/pr_distribution.json
• pr_output /app/data/pr_computation/ej/1eja/1eja.pr.out
• pr_plot /app/data/visualization/pr_computation/ej/1eja/1eja_pr_distribution.png
• saxs_curve_dat /app/data/saxs_computation/ej/1eja/1eja.dat
• saxs_fit /app/data/saxs_computation/ej/1eja/1eja.fit
• saxs_log /app/data/saxs_computation/ej/1eja/1eja.log
• saxs_plot /app/data/visualization/saxs_computation/ej/1eja/1eja_saxs_profile.png

Curves (3)

fit	/app/data/saxs_computation/ej/1eja/1eja.fit
pddf	/app/data/pr_computation/ej/1eja/1eja.pr.out
profile	/app/data/saxs_computation/ej/1eja/1eja.dat