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1ets

;REFINED 2.3 ANGSTROMS X-RAY CRYSTAL STRUCTURE OF BOVINE THROMBIN COMPLEXES FORMED WITH THE BENZAMIDINE AND ARGININE-BASED THROMBIN INHIBITORS NAPAP, 4-TAPAP AND MQPA: A STARTING POINT FOR IMPROVING ANTITHROMBOTICS ;

Method: X-RAY DIFFRACTION Dmax: 60.9 Å Quality: GOOD

SAXS Profile

SAXS profile for 1ets

P(r) Distribution

P(r) distribution for 1ets

1. Structure Basics

entry_id1ets
deposition_date1992-07-06
title;REFINED 2.3 ANGSTROMS X-RAY CRYSTAL STRUCTURE OF BOVINE THROMBIN COMPLEXES FORMED WITH THE BENZAMIDINE AND ARGININE-BASED THROMBIN INHIBITORS NAPAP, 4-TAPAP AND MQPA: A STARTING POINT FOR IMPROVING ANTITHROMBOTICS ;
keywordsSERINE PROTEINASE, HYDROLASE-HYDROLASE INHIBITOR COMPLEX; HYDROLASE/HYDROLASE inhibitor
methodX-RAY DIFFRACTION

Download Data

2. SAXS Parameters (CRYSOL)

rg_guinier19.35
rg_electron18.15
i020255500.00
molecular_weight34377.0 kDa
excluded_volume43156 ų
envelope_volume49914 ų
shell_volume21883 ų
envelope_diameter62.3
shell_rg25.48
envelope_rg18.59
shape_rg18.13
total_rg19.22
total_atoms2980
n_residues295
n_harmonics20
q_range— – 0.5000 −1
n_points101
shell_typedirectional
solvent_density0.3340 e/ų
contrast_shell0.0300 e/ų
crysol_version4.1.3

3. P(r) Analysis (GNOM)

dmax60.9
rg_real19.18
rg_real_error0.36
i0_real2.0260e+07
i0_real_error2.6610e+05
rg_reciprocal19.21
i0_reciprocal20260000.0000
total_estimate0.8094
solution_quality GOOD a GOOD solution
n_peaks3
r_peak_primary25.8
skewness0.079
kurtosis-0.457
angular_range— – 0.4100 −1
current_alpha0.0000
highest_alpha10540000.0000
n_real_points72
gnom_version4.1.3
quality_criteria AN1: 0.000; Oscil: 0.845; Stabil: 0.999; Sysdev: 1.000; Positv: 1.000; Valcen: 0.987; Smooth: 0.000

4. Crystallography & Experiment

5. Entities & Polymer Info (4)

6. Citations (7)

7. Files & Curves (10)