GLUTATHIONE S-TRANSFERASE P1-1 APO FORM 1

Method: X-RAY DIFFRACTION D_max: 64.5 Å Quality: EXCELLENT

SAXS Profile

P(r) Distribution

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1. Structure Basics

entry_id	14gs
deposition_date	1997-11-29
title	GLUTATHIONE S-TRANSFERASE P1-1 APO FORM 1
keywords	TRANSFERASE, APOENZYME, DETOXIFICATION; TRANSFERASE
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	21.89 Å
rg_electron	20.94 Å
i0	29976900.00
molecular_weight	43660.0 kDa
excluded_volume	55323 Å³
envelope_volume	63686 Å³
shell_volume	24796 Å³
envelope_diameter	66.5 Å
shell_rg	27.99 Å
envelope_rg	20.86 Å
shape_rg	20.92 Å
total_rg	21.87 Å
total_atoms	3078
n_residues	388
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	64.5 Å
rg_real	21.73 Å
rg_real_error	0.25 Å
i0_real	2.9980e+07
i0_real_error	3.7220e+05
rg_reciprocal	21.76 Å
i0_reciprocal	29980000.0000
total_estimate	0.9123
solution_quality	EXCELLENT a EXCELLENT solution
n_peaks	2
r_peak_primary	27.9 Å
skewness	0.116
kurtosis	-0.542
angular_range	— – 0.3650 Å⁻¹
current_alpha	0.0000
highest_alpha	8768000.0000
n_real_points	68
gnom_version	4.1.3
quality_criteria	AN1: 0.000; Oscil: 0.961; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.987; Smooth: 0.985

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4. Crystallography & Experiment

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5. Entities & Polymer Info (3)

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6. Citations (1)

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length_a	78.651 Å
length_b	91.826 Å
length_c	69.143 Å
angle_alpha	90.00 °
angle_beta	98.25 °
angle_gamma	90.00 °
z_pdb	8

space_group	C 1 2 1
int_tables_number	5
crystal_system	—

resolution	2.800 Å
resolution_low	15.000 Å
r_factor	0.1900
r_work	0.1900
r_free	0.2400

description	GLUTATHIONE S-TRANSFERASE
formula_weight	23377.8 kDa
ec_number	2.5.1.18
src_method	man
entity_count	2

type	polypeptide(L)
strand_id	A,B
atom_count	3083

GLUTATHIONE S-TRANSFERASE P1-1 APO FORM 1

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 (3)

Entity 1 polymer

Polymer

Source

Entity 2 non-polymer

Entity 3 water

6. Citations (1)

7. Files & Curves (10)

Files (7)

Curves (3)

organism	Homo sapiens
common_name	human
ncbi_taxonomy_id	9606
host_organism	Escherichia coli

description	2-(N-MORPHOLINO)-ETHANESULFONIC ACID
formula_weight	195.2 kDa
src_method	syn
entity_count	2

description	water
formula_weight	18.0 kDa
src_method	nat
entity_count	5

fit	/app/data/saxs_computation/4g/14gs/14gs.fit
pddf	/app/data/pr_computation/4g/14gs/14gs.pr.out
profile	/app/data/saxs_computation/4g/14gs/14gs.dat