SOLUTION NMR
| NMR Refinement | ||
|---|---|---|
| Method | Details | Software |
| A TOTAL OF 50 STRUCTURES WERE CALCULATED. THE COORDINATES OF THE RESTRAINED MINIMIZED AVERAGED STRUCTURE WERE OBTAINED BY AVERAGING THE COORDINATES OF THE INDIVIDUAL STRUCTURES, AND THEN BY SUBJECTING THE RESULTING COORDINATES TO THE RESTRAINED ENERGY MINIMIZATION BY PRESTO. | EMBOSS | |
| NMR Ensemble Information | |
|---|---|
| Conformer Selection Criteria | |
| Conformers Calculated Total Number | |
| Conformers Submitted Total Number | 1 |
| Computation: NMR Software | ||||
|---|---|---|---|---|
| # | Classification | Version | Software Name | Author |
| 1 | refinement | EMBOSS | NAKAI,KIDERA,NAKAMURA | |
| 2 | refinement | PRESTO | MORIKAMI,NAKAI,KIDERA,SAITO,NAKAMURA | |
