BROMOPEROXIDASE A1

Method: X-RAY DIFFRACTION D_max: 58.3 Å Quality: GOOD

SAXS Profile

P(r) Distribution

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1. Structure Basics

entry_id	1a8q
deposition_date	1998-03-27
title	BROMOPEROXIDASE A1
keywords	HALOPEROXIDASE, OXIDOREDUCTASE; HALOPEROXIDASE
method	X-RAY DIFFRACTION

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Download Data

SAXS curve (.dat) P(r) distribution (.pr.out) Structure (CIF)

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2. SAXS Parameters (CRYSOL)

rg_guinier	18.50 Å
rg_electron	17.21 Å
i0	16576900.00
molecular_weight	30332.0 kDa
excluded_volume	37680 Å³
envelope_volume	41676 Å³
shell_volume	19588 Å³
envelope_diameter	57.0 Å
shell_rg	24.08 Å
envelope_rg	17.44 Å
shape_rg	17.19 Å
total_rg	18.21 Å
total_atoms	2143
n_residues	274
n_harmonics	20
q_range	— – 0.5000 Å⁻¹
n_points	101
shell_type	directional
solvent_density	0.3340 e/Å³
contrast_shell	0.0300 e/Å³
crysol_version	4.1.3

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3. P(r) Analysis (GNOM)

dmax	58.3 Å
rg_real	18.34 Å
rg_real_error	0.33 Å
i0_real	1.6580e+07
i0_real_error	2.1900e+05
rg_reciprocal	18.36 Å
i0_reciprocal	16580000.0000
total_estimate	0.8099
solution_quality	GOOD a GOOD solution
n_peaks	3
r_peak_primary	24.7 Å
skewness	0.026
kurtosis	-0.500
angular_range	— – 0.4300 Å⁻¹
current_alpha	0.0000
highest_alpha	4432000.0000
n_real_points	74
gnom_version	4.1.3
quality_criteria	AN1: 0.000; Oscil: 0.849; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.978; Smooth: 0.000

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4. Crystallography & Experiment

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5. Entities & Polymer Info (2)

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6. Citations (1)

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length_a	80.770 Å
length_b	80.770 Å
length_c	91.870 Å
angle_alpha	90.00 °
angle_beta	90.00 °
angle_gamma	120.00 °
z_pdb	6

space_group	P 63
int_tables_number	173
crystal_system	—

resolution	1.750 Å
resolution_low	70.000 Å
r_factor	0.1580
r_work	0.1690
r_free	0.1820

description	BROMOPEROXIDASE A1
formula_weight	30382.0 kDa
ec_number	1.11.1.10
src_method	man
entity_count	1

type	polypeptide(L)
strand_id	A
atom_count	2350

BROMOPEROXIDASE A1

SAXS Profile

P(r) Distribution

1. Structure Basics

Download Data

2. SAXS Parameters (CRYSOL)

3. P(r) Analysis (GNOM)

4. Crystallography & Experiment

Unit Cell

Symmetry

Refinement

Diffraction

5. Entities & Polymer Info (2)

Entity 1 polymer

Polymer

Source

Entity 2 water

6. Citations (1)

7. Files & Curves (10)

Files (7)

Curves (3)

organism	Streptomyces aureofaciens
ncbi_taxonomy_id	1894
host_organism	Streptomyces lividans

description	water
formula_weight	18.0 kDa
src_method	nat
entity_count	207

fit	/app/data/saxs_computation/a8/1a8q/1a8q.fit
pddf	/app/data/pr_computation/a8/1a8q/1a8q.pr.out
profile	/app/data/saxs_computation/a8/1a8q/1a8q.dat