BETAINE ALDEHYDE DEHYDROGENASE FROM COD LIVER

Method: X-RAY DIFFRACTION D_max: 110.4 Å Quality: GOOD

SAXS Profile

P(r) Distribution

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1. Structure Basics

entry_id	1a4s
deposition_date	1998-02-03
title	BETAINE ALDEHYDE DEHYDROGENASE FROM COD LIVER
keywords	OXIDOREDUCTASE, ALDEHYDE OXIDATION; OXIDOREDUCTASE
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	37.46 Å
rg_electron	36.76 Å
i0	703120000.00
molecular_weight	217450.0 kDa
excluded_volume	272500 Å³
envelope_volume	326840 Å³
shell_volume	70280 Å³
envelope_diameter	115.6 Å
shell_rg	45.61 Å
envelope_rg	36.64 Å
shape_rg	36.71 Å
total_rg	37.40 Å
total_atoms	15232
n_residues	2012
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	110.4 Å
rg_real	37.17 Å
rg_real_error	0.54 Å
i0_real	7.0310e+08
i0_real_error	1.0910e+07
rg_reciprocal	37.36 Å
i0_reciprocal	703200000.0000
total_estimate	0.8913
solution_quality	GOOD a GOOD solution
n_peaks	1
r_peak_primary	47.3 Å
skewness	0.056
kurtosis	-0.584
angular_range	— – 0.2100 Å⁻¹
current_alpha	0.0000
highest_alpha	118000000.0000
n_real_points	43
gnom_version	4.1.3
quality_criteria	AN1: 0.000; Oscil: 0.962; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.974; Smooth: 0.724

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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	84.170 Å
length_b	86.220 Å
length_c	88.330 Å
angle_alpha	105.20 °
angle_beta	115.13 °
angle_gamma	100.02 °
z_pdb	4

space_group	P 1
int_tables_number	1
crystal_system	—

resolution	2.100 Å
resolution_low	8.000 Å
r_factor	0.2230
r_work	0.2230
r_free	0.2530

description	BETAINE ALDEHYDE DEHYDROGENASE
formula_weight	54422.4 kDa
ec_number	1.2.1.8
src_method	nat
entity_count	4

type	polypeptide(L)
strand_id	A,B,C,D
atom_count	15925

BETAINE ALDEHYDE DEHYDROGENASE FROM COD LIVER

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

Entity 2 water

6. Citations (1)

7. Files & Curves (10)

Files (7)

Curves (3)

description	water
formula_weight	18.0 kDa
src_method	nat
entity_count	693

fit	/app/data/saxs_computation/a4/1a4s/1a4s.fit
pddf	/app/data/pr_computation/a4/1a4s/1a4s.pr.out
profile	/app/data/saxs_computation/a4/1a4s/1a4s.dat