ANIONIC TRYPSIN WILD TYPE

Method: X-RAY DIFFRACTION D_max: 52.0 Å Quality: EXCELLENT

SAXS Profile

P(r) Distribution

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1. Structure Basics

entry_id	1ane
deposition_date	1994-12-21
title	ANIONIC TRYPSIN WILD TYPE
keywords	TRYPSIN, ANIONIC, SERINE PROTEASE, HYDROLASE; SERINE PROTEASE
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	17.14 Å
rg_electron	16.08 Å
i0	10836600.00
molecular_weight	23894.0 kDa
excluded_volume	29583 Å³
envelope_volume	32376 Å³
shell_volume	16578 Å³
envelope_diameter	53.0 Å
shell_rg	22.41 Å
envelope_rg	16.31 Å
shape_rg	16.09 Å
total_rg	17.02 Å
total_atoms	1674
n_residues	223
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	52.0 Å
rg_real	17.01 Å
rg_real_error	0.21 Å
i0_real	1.0840e+07
i0_real_error	1.1000e+05
rg_reciprocal	17.03 Å
i0_reciprocal	10840000.0000
total_estimate	0.9032
solution_quality	EXCELLENT a EXCELLENT solution
n_peaks	2
r_peak_primary	21.9 Å
skewness	0.094
kurtosis	-0.484
angular_range	— – 0.4650 Å⁻¹
current_alpha	0.0000
highest_alpha	2727000.0000
n_real_points	77
gnom_version	4.1.3
quality_criteria	AN1: 0.000; Oscil: 0.924; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.983; Smooth: 0.984

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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	124.380 Å
length_b	124.380 Å
length_c	124.380 Å
angle_alpha	90.00 °
angle_beta	90.00 °
angle_gamma	90.00 °
z_pdb	24

space_group	I 2 3
int_tables_number	197
crystal_system	—

resolution	2.200 Å
resolution_low	— Å
r_factor	0.1750
r_work	0.1750
r_free	—

description	ANIONIC TRYPSIN
formula_weight	23814.8 kDa
ec_number	3.4.21.4
src_method	man
entity_count	1

type	polypeptide(L)
strand_id	A
atom_count	1798

ANIONIC TRYPSIN WILD TYPE

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	Rattus rattus
common_name	black rat
ncbi_taxonomy_id	10117
host_organism	Escherichia coli

description	BENZAMIDINE
formula_weight	120.2 kDa
src_method	syn
entity_count	1

description	water
formula_weight	18.0 kDa
src_method	nat
entity_count	124

fit	/app/data/saxs_computation/an/1ane/1ane.fit
pddf	/app/data/pr_computation/an/1ane/1ane.pr.out
profile	/app/data/saxs_computation/an/1ane/1ane.dat