BAR-HEADED GOOSE HEMOGLOBIN (AQUOMET FORM)

entry_id	1c40
deposition_date	1999-08-03
title	BAR-HEADED GOOSE HEMOGLOBIN (AQUOMET FORM)
keywords	OXYGEN TRANSPORT, HEME, RESPIRATORY PROTEIN, ERYTHROCYTE, OXYGEN STORAGE/ TRANSPORT, OXYGEN STORAGE-TRANSPORT COMPLEX; OXYGEN STORAGE/TRANSPORT
method	X-RAY DIFFRACTION

rg_guinier	20.49 Å
rg_electron	19.24 Å
i0	17316500.00
molecular_weight	32866.0 kDa
excluded_volume	41702 ų
envelope_volume	47742 ų
shell_volume	20593 ų
envelope_diameter	59.4 Å
shell_rg	25.53 Å
envelope_rg	19.26 Å
shape_rg	19.22 Å
total_rg	20.20 Å
total_atoms	2322
n_residues	287
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	60.0 Å
rg_real	20.36 Å
rg_real_error	0.24 Å
i0_real	1.7320e+07
i0_real_error	1.8260e+05
rg_reciprocal	20.39 Å
i0_reciprocal	17320000.0000
total_estimate	0.9127
solution_quality	EXCELLENT a EXCELLENT solution
n_peaks	2
r_peak_primary	26.6 Å
skewness	0.105
kurtosis	-0.562
angular_range	— – 0.3900 Å−1
current_alpha	0.0000
highest_alpha	3168000.0000
n_real_points	71
gnom_version	4.1.3
quality_criteria	AN1: 0.000; Oscil: 0.968; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.991; Smooth: 0.965

Unit Cell

length_a	81.497 Å
length_b	81.497 Å
length_c	107.200 Å
angle_alpha	90.00 °
angle_beta	90.00 °
angle_gamma	90.00 °
z_pdb	8

Symmetry

space_group	P 42 21 2
int_tables_number	94
crystal_system	—

Refinement

resolution	2.300 Å
resolution_low	26.900 Å
r_factor	0.1970
r_work	0.1970
r_free	0.2470

Diffraction

temperature

293.0 K

Files (7)

• pr_distribution /app/data/pr_computation/c4/1c40/pr_distribution.json
• pr_output /app/data/pr_computation/c4/1c40/1c40.pr.out
• pr_plot /app/data/visualization/pr_computation/c4/1c40/1c40_pr_distribution.png
• saxs_curve_dat /app/data/saxs_computation/c4/1c40/1c40.dat
• saxs_fit /app/data/saxs_computation/c4/1c40/1c40.fit
• saxs_log /app/data/saxs_computation/c4/1c40/1c40.log
• saxs_plot /app/data/visualization/saxs_computation/c4/1c40/1c40_saxs_profile.png

Curves (3)

fit	/app/data/saxs_computation/c4/1c40/1c40.fit
pddf	/app/data/pr_computation/c4/1c40/1c40.pr.out
profile	/app/data/saxs_computation/c4/1c40/1c40.dat