1cqg
;HIGH RESOLUTION SOLUTION NMR STRUCTURE OF MIXED DISULFIDE INTERMEDIATE BETWEEN HUMAN THIOREDOXIN (C35A, C62A, C69A, C73A) MUTANT AND A 13 RESIDUE PEPTIDE COMPRISING ITS TARGET SITE IN HUMAN REF-1 (RESIDUES 59-71 OF THE P50 SUBUNIT OF NFKB), NMR, 31 STRUCTURES ;
SAXS Profile
P(r) Distribution
1. Structure Basics
| entry_id | 1cqg |
| deposition_date | 1996-04-02 |
| title | ;HIGH RESOLUTION SOLUTION NMR STRUCTURE OF MIXED DISULFIDE INTERMEDIATE BETWEEN HUMAN THIOREDOXIN (C35A, C62A, C69A, C73A) MUTANT AND A 13 RESIDUE PEPTIDE COMPRISING ITS TARGET SITE IN HUMAN REF-1 (RESIDUES 59-71 OF THE P50 SUBUNIT OF NFKB), NMR, 31 STRUCTURES ; |
| keywords | COMPLEX, ELECTRON TRANSPORT/PEPTIDE, COMPLEX (ELECTRON TRANSPORT-PEPTIDE) COMPLEX; COMPLEX (ELECTRON TRANSPORT/PEPTIDE) |
| method | SOLUTION NMR |
Download Data
2. SAXS Parameters (CRYSOL)
| rg_guinier | 13.76 Å |
| rg_electron | 13.52 Å |
| i0 | 2636670000.00 |
| molecular_weight | 454220.0 kDa |
| excluded_volume | 573970 ų |
| envelope_volume | 22999 ų |
| shell_volume | 13414 ų |
| envelope_diameter | 50.0 Å |
| shell_rg | 20.42 Å |
| envelope_rg | 14.78 Å |
| shape_rg | 13.47 Å |
| total_rg | 13.78 Å |
| total_atoms | 63595 |
| n_residues | 4130 |
| n_harmonics | 20 |
| q_range | — – 0.5000 Å−1 |
| n_points | 101 |
| shell_type | directional |
| solvent_density | 0.3340 e/ų |
| contrast_shell | 0.0300 e/ų |
| crysol_version | 4.1.3 |
3. P(r) Analysis (GNOM)
| dmax | 43.7 Å |
| rg_real | 13.68 Å |
| rg_real_error | 0.25 Å |
| i0_real | 2.6370e+09 |
| i0_real_error | 2.7490e+07 |
| rg_reciprocal | 13.68 Å |
| i0_reciprocal | 2637000000.0000 |
| total_estimate | 0.7917 |
| solution_quality | GOOD a GOOD solution |
| n_peaks | 1 |
| r_peak_primary | 41.0 Å |
| skewness | 0.125 |
| kurtosis | -0.284 |
| angular_range | — – 0.5000 Å−1 |
| current_alpha | 0.0000 |
| highest_alpha | 322100.0000 |
| n_real_points | 80 |
| gnom_version | 4.1.3 |
| quality_criteria | AN1: 0.000; Oscil: 0.767; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.987; Smooth: 0.000 |