7-FE FERREDOXIN FROM BACILLUS SCHLEGELII, NMR, MINIMIZED AVERAGE STRUCTURE

Method: SOLUTION NMR D_max: 38.4 Å Quality: REASONABLE

SAXS Profile

P(r) Distribution

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1. Structure Basics

entry_id	1bd6
deposition_date	1998-05-06
title	7-FE FERREDOXIN FROM BACILLUS SCHLEGELII, NMR, MINIMIZED AVERAGE STRUCTURE
keywords	ELECTRON TRANSPORT, IRON-SULFUR; ELECTRON TRANSPORT
method	SOLUTION NMR

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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	11.92 Å
rg_electron	11.00 Å
i0	2206780.00
molecular_weight	9380.0 kDa
excluded_volume	11185 Å³
envelope_volume	11397 Å³
shell_volume	8869 Å³
envelope_diameter	35.8 Å
shell_rg	16.62 Å
envelope_rg	11.34 Å
shape_rg	11.10 Å
total_rg	11.97 Å
total_atoms	1182
n_residues	77
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	38.4 Å
rg_real	11.84 Å
rg_real_error	0.28 Å
i0_real	2.2070e+06
i0_real_error	2.3750e+04
rg_reciprocal	11.85 Å
i0_reciprocal	2207000.0000
total_estimate	0.7328
solution_quality	REASONABLE a REASONABLE solution
n_peaks	2
r_peak_primary	16.0 Å
skewness	0.103
kurtosis	-0.315
angular_range	— – 0.5000 Å⁻¹
current_alpha	0.0000
highest_alpha	193600.0000
n_real_points	80
gnom_version	4.1.3
quality_criteria	AN1: 0.000; Oscil: 0.830; Stabil: 0.997; Sysdev: 0.368; Positv: 1.000; Valcen: 0.997; Smooth: 0.940

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4. Crystallography & Experiment

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5. Entities & Polymer Info (3)

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6. Citations (4)

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length_a	1.000 Å
length_b	1.000 Å
length_c	1.000 Å
angle_alpha	90.00 °
angle_beta	90.00 °
angle_gamma	90.00 °
z_pdb	1

space_group	P 1
int_tables_number	1
crystal_system	—

description	7-FE FERREDOXIN
formula_weight	8750.8 kDa
src_method	man
entity_count	1

type	polypeptide(L)
strand_id	A
atom_count	1182

organism	Bacillus schlegelii
ncbi_taxonomy_id	1484
host_organism	Escherichia coli

7-FE FERREDOXIN FROM BACILLUS SCHLEGELII, NMR, MINIMIZED AVERAGE STRUCTURE

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

5. Entities & Polymer Info (3)

Entity 1 polymer

Polymer

Source

Entity 2 non-polymer

Entity 3 non-polymer

6. Citations (4)

7. Files & Curves (10)

Files (7)

Curves (3)

description	FE3-S4 CLUSTER
formula_weight	295.8 kDa
src_method	syn
entity_count	1

description	IRON/SULFUR CLUSTER
formula_weight	351.6 kDa
src_method	syn
entity_count	1

fit	/app/data/saxs_computation/bd/1bd6/1bd6.fit
pddf	/app/data/pr_computation/bd/1bd6/1bd6.pr.out
profile	/app/data/saxs_computation/bd/1bd6/1bd6.dat