Ixekizumab Fab in complex with human IL-17A

entry_id	9sg2
deposition_date	2025-08-21
last_revision	2025-10-29
title	Ixekizumab Fab in complex with human IL-17A
keywords	CYTOKINE, Therapeutic antibody, Ixekizumab; CYTOKINE
method	X-RAY DIFFRACTION

rg_guinier	29.96 Å
rg_electron	29.74 Å
i0	58017400.00
molecular_weight	58729.0 kDa
excluded_volume	73034 ų
envelope_volume	98652 ų
shell_volume	29402 ų
envelope_diameter	114.7 Å
shell_rg	34.55 Å
envelope_rg	30.61 Å
shape_rg	29.69 Å
total_rg	30.36 Å
total_atoms	4131
n_residues	533
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	107.5 Å
rg_real	30.22 Å
rg_real_error	1.12 Å
i0_real	5.8020e+07
i0_real_error	9.1170e+05
rg_reciprocal	30.11 Å
i0_reciprocal	58010000.0000
total_estimate	0.6370
solution_quality	REASONABLE a REASONABLE solution
n_peaks	2
r_peak_primary	30.4 Å
skewness	0.584
kurtosis	-0.056
angular_range	— – 0.2650 Å−1
current_alpha	0.0000
highest_alpha	7417000.0000
n_real_points	54
gnom_version	4.1.3
quality_criteria	AN1: 0.000; Oscil: 0.714; Stabil: 1.000; Sysdev: 0.135; Positv: 1.000; Valcen: 0.764; Smooth: 0.964

Unit Cell

length_a	125.730 Å
length_b	125.730 Å
length_c	107.530 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	2.920 Å
resolution_low	81.720 Å
r_factor	0.1950
r_work	0.1920
r_free	0.2460

Diffraction

temperature

100.0 K

Files (7)

• pr_distribution /app/data/pr_computation/sg/9sg2/pr_distribution.json
• pr_output /app/data/pr_computation/sg/9sg2/9sg2.pr.out
• pr_plot /app/data/visualization/pr_computation/sg/9sg2/9sg2_pr_distribution.png
• saxs_curve_dat /app/data/saxs_computation/sg/9sg2/9sg2.dat
• saxs_fit /app/data/saxs_computation/sg/9sg2/9sg2.fit
• saxs_log /app/data/saxs_computation/sg/9sg2/9sg2.log
• saxs_plot /app/data/visualization/saxs_computation/sg/9sg2/9sg2_saxs_profile.png

Curves (3)

fit	/app/data/saxs_computation/sg/9sg2/9sg2.fit
pddf	/app/data/pr_computation/sg/9sg2/9sg2.pr.out
profile	/app/data/saxs_computation/sg/9sg2/9sg2.dat