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9q55

;Structure of human endothelial nitric oxide synthase heme domain bound with 6-((2,3-difluoro-5-(2-(4-fluoropiperidin-1-yl)ethyl)phenoxy)methyl)-4-methylpyridin-2-amine ;

Method: X-RAY DIFFRACTION Dmax: 143.2 Å Quality: GOOD

SAXS Profile

SAXS profile for 9q55

P(r) Distribution

P(r) distribution for 9q55
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1. Structure Basics

entry_id9q55
deposition_date2025-08-20
title;Structure of human endothelial nitric oxide synthase heme domain bound with 6-((2,3-difluoro-5-(2-(4-fluoropiperidin-1-yl)ethyl)phenoxy)methyl)-4-methylpyridin-2-amine ;
keywordsnitric oxide synthase inhibitor binding, OXIDOREDUCTASE-INHIBITOR complex, OXIDOREDUCTASE; OXIDOREDUCTASE/INHIBITOR
methodX-RAY DIFFRACTION
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Download Data

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2. SAXS Parameters (CRYSOL)

rg_guinier43.12 Å
rg_electron42.79 Å
i01026390000.00
molecular_weight175950.0 kDa
excluded_volume169950 ų
envelope_volume298810 ų
shell_volume58083 ų
envelope_diameter150.1 Å
shell_rg47.73 Å
envelope_rg42.59 Å
shape_rg42.80 Å
total_rg42.92 Å
total_atoms13290
n_residues1604
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)

dmax143.2 Å
rg_real43.17 Å
rg_real_error1.69 Å
i0_real1.0260e+09
i0_real_error1.7900e+07
rg_reciprocal43.12 Å
i0_reciprocal1026000000.0000
total_estimate0.8861
solution_quality GOOD a GOOD solution
n_peaks1
r_peak_primary38.7 Å
skewness0.279
kurtosis-0.610
angular_range— – 0.1850 Å−1
current_alpha0.0000
highest_alpha132000000.0000
n_real_points38
gnom_version4.1.3
quality_criteria AN1: 0.000; Oscil: 0.887; Stabil: 0.999; Sysdev: 1.000; Positv: 1.000; Valcen: 0.971; Smooth: 0.887
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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)