;THERMODYNAMIC AND STRUCTURAL COMPENSATION IN "SIZE-SWITCH" CORE-REPACKING VARIANTS OF T4 LYSOZYME ;

entry_id	198l
deposition_date	1995-11-06
title	;THERMODYNAMIC AND STRUCTURAL COMPENSATION IN "SIZE-SWITCH" CORE-REPACKING VARIANTS OF T4 LYSOZYME ;
keywords	CAVITIES, CORE-PACKING, PROTEIN STABILITY, HYDROLASE (O-GLYCOSYL); HYDROLASE (O-GLYCOSYL)
method	X-RAY DIFFRACTION

rg_guinier	17.43 Å
rg_electron	16.46 Å
i0	6608170.00
molecular_weight	18592.0 kDa
excluded_volume	23272 ų
envelope_volume	26601 ų
shell_volume	14117 ų
envelope_diameter	59.1 Å
shell_rg	21.74 Å
envelope_rg	16.52 Å
shape_rg	16.44 Å
total_rg	17.44 Å
total_atoms	1302
n_residues	162
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	57.8 Å
rg_real	17.42 Å
rg_real_error	0.45 Å
i0_real	6.6080e+06
i0_real_error	8.3540e+04
rg_reciprocal	17.42 Å
i0_reciprocal	6608000.0000
total_estimate	0.7906
solution_quality	GOOD a GOOD solution
n_peaks	3
r_peak_primary	21.6 Å
skewness	0.351
kurtosis	-0.208
angular_range	— – 0.4550 Å−1
current_alpha	0.0000
highest_alpha	1443000.0000
n_real_points	76
gnom_version	4.1.3
quality_criteria	AN1: 0.000; Oscil: 0.768; Stabil: 0.996; Sysdev: 1.000; Positv: 1.000; Valcen: 0.983; Smooth: 0.000

Unit Cell

length_a	61.100 Å
length_b	61.100 Å
length_c	96.100 Å
angle_alpha	90.00 °
angle_beta	90.00 °
angle_gamma	120.00 °
z_pdb	6

Symmetry

space_group	P 32 2 1
int_tables_number	154
crystal_system	—

Refinement

resolution	2.000 Å
resolution_low	10.000 Å
r_factor	0.1580
r_work	—
r_free	—

Diffraction

temperature

298.0 K

Files (7)

• pr_distribution /app/data/pr_computation/98/198l/pr_distribution.json
• pr_output /app/data/pr_computation/98/198l/198l.pr.out
• pr_plot /app/data/visualization/pr_computation/98/198l/198l_pr_distribution.png
• saxs_curve_dat /app/data/saxs_computation/98/198l/198l.dat
• saxs_fit /app/data/saxs_computation/98/198l/198l.fit
• saxs_log /app/data/saxs_computation/98/198l/198l.log
• saxs_plot /app/data/visualization/saxs_computation/98/198l/198l_saxs_profile.png

Curves (3)

fit	/app/data/saxs_computation/98/198l/198l.fit
pddf	/app/data/pr_computation/98/198l/198l.pr.out
profile	/app/data/saxs_computation/98/198l/198l.dat