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9q51

;Structure of human endothelial nitric oxide synthase heme domain bound with 6-((5-(2-(diethylamino)ethyl)-2,3-difluorophenxy)methyl)-4-methylpyridin-2-amine ;

Method: X-RAY DIFFRACTION Dmax: 141.5 Å Quality: GOOD

SAXS Profile

SAXS profile for 9q51

P(r) Distribution

P(r) distribution for 9q51
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1. Structure Basics

entry_id9q51
deposition_date2025-08-20
title;Structure of human endothelial nitric oxide synthase heme domain bound with 6-((5-(2-(diethylamino)ethyl)-2,3-difluorophenxy)methyl)-4-methylpyridin-2-amine ;
keywords;nitric oxide synthase inhibitor binding, OXIDOREDUCTASE-INHIBITOR complex, OXIDOREDUCTASE, OXIDOREDUCTASE-OXIDOREDUCTASE INHIBITOR complex ;; OXIDOREDUCTASE/OXIDOREDUCTASE INHIBITOR
methodX-RAY DIFFRACTION
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Download Data

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2. SAXS Parameters (CRYSOL)

rg_guinier43.23 Å
rg_electron42.95 Å
i01041900000.00
molecular_weight176920.0 kDa
excluded_volume170650 ų
envelope_volume302960 ų
shell_volume58746 ų
envelope_diameter150.4 Å
shell_rg47.62 Å
envelope_rg42.71 Å
shape_rg42.98 Å
total_rg43.03 Å
total_atoms13344
n_residues1607
n_harmonics20
q_range— – 0.5000 Å−1
n_points101
shell_typedirectional
solvent_density0.3340 e/ų
contrast_shell0.0300 e/ų
crysol_version4.1.3
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3. P(r) Analysis (GNOM)

dmax141.5 Å
rg_real43.28 Å
rg_real_error1.55 Å
i0_real1.0420e+09
i0_real_error1.8960e+07
rg_reciprocal43.23 Å
i0_reciprocal1042000000.0000
total_estimate0.8864
solution_quality GOOD a GOOD solution
n_peaks1
r_peak_primary42.1 Å
skewness0.286
kurtosis-0.600
angular_range— – 0.1850 Å−1
current_alpha0.0000
highest_alpha137200000.0000
n_real_points38
gnom_version4.1.3
quality_criteria AN1: 0.000; Oscil: 0.902; Stabil: 0.998; Sysdev: 1.000; Positv: 1.000; Valcen: 0.978; Smooth: 0.841
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4. Crystallography & Experiment

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5. Entities & Polymer Info (11)

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6. Citations (1)

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7. Files & Curves (10)