3-[(3'-aminomethyl-biphenyl-4-carbonyl)-amino]-2-(3-carbamimidoyl-benzyl)-butyric acid methyl ester (RPR) Summary
- Home
- 3-[(3'-aminomethyl-biphenyl-4-carbonyl)-amino]-2-(3-carbamimidoyl-benzyl)-butyric acid methyl ester (RPR) Summary
- Dihedrals
Dihedrals Table
| Dih. | Atom names | Experimental | Type |
|---|---|---|---|
| 1 | C.1-C.2-C.3-C.43-2-1-0 C.4-C.3-C.2-C.1 | 0.11 | Rigid Ring |
| 2 | C.1-C.2-C.11-C.109-10-1-0 C.10-C.11-C.2-C.1 | 50.045 | Flexible |
| 3 | C.1-C.2-C.11-C.1211-10-1-0 C.12-C.11-C.2-C.1 | -129.938 | Flexible |
| 4 | C.1-C.6-C.5-C.43-4-5-0 C.4-C.5-C.6-C.1 | -0.067 | Rigid Ring |
| 5 | C.1-C.6-C.21-N.2221-20-5-0 C.22-C.21-C.6-N.1 | 73.276 | Flexible |
| 6 | C.2-C.1-C.6-C.54-5-0-1 C.5-C.6-C.1-C.2 | 0.043 | Rigid Ring |
| 7 | C.2-C.1-C.6-C.2120-5-0-1 C.21-C.6-C.1-C.2 | 179.947 | Rigid |
| 8 | C.2-C.3-C.4-C.54-3-2-1 C.5-C.4-C.3-C.2 | -0.138 | Rigid Ring |
| 9 | C.2-C.11-C.10-C.98-9-10-1 C.9-C.10-C.11-C.2 | -179.954 | Rigid |
| 10 | C.2-C.11-C.12-C.76-11-10-1 C.7-C.12-C.11-C.2 | 179.978 | Rigid |
| 11 | C.3-C.2-C.11-C.109-10-1-2 C.10-C.11-C.2-C.3 | -130.019 | Flexible |
| 12 | C.3-C.2-C.11-C.1211-10-1-2 C.12-C.11-C.2-C.3 | 49.998 | Flexible |
| 13 | C.3-C.4-C.5-C.65-4-3-2 C.6-C.5-C.4-C.3 | 0.113 | Rigid Ring |
| 14 | C.4-C.3-C.2-C.1110-1-2-3 C.11-C.2-C.3-C.4 | -179.828 | Rigid |
| 15 | C.4-C.5-C.6-C.2120-5-4-3 C.21-C.6-C.5-C.4 | -179.971 | Rigid |
| 16 | C.5-C.6-C.21-N.2221-20-5-4 C.22-C.21-C.6-N.5 | -106.82 | Flexible |
| 17 | C.6-C.1-C.2-C.32-1-0-5 C.3-C.2-C.1-C.6 | -0.062 | Rigid Ring |
| 18 | C.6-C.1-C.2-C.1110-1-0-5 C.11-C.2-C.1-C.6 | 179.876 | Rigid |
| 19 | C.7-C.8-C.9-C.109-8-7-6 C.10-C.9-C.8-C.7 | 0.049 | Rigid Ring |
| 20 | C.7-C.8-C.13-N.1413-12-7-6 C.14-C.13-C.8-N.7 | 26.694 | Flexible |
| 21 | C.7-C.8-C.13-O.3332-12-7-6 C.33-C.13-C.8-O.7 | -152.88 | Flexible |
| 22 | C.7-C.12-C.11-C.109-10-11-6 C.10-C.11-C.12-C.7 | -0.006 | Rigid Ring |
| 23 | C.8-C.7-C.12-C.1110-11-6-7 C.11-C.12-C.7-C.8 | 0.004 | Rigid Ring |
| 24 | C.8-C.9-C.10-C.1110-9-8-7 C.11-C.10-C.9-C.8 | -0.052 | Rigid Ring |
| 25 | C.8-C.13-N.14-C.1514-13-12-7 C.15-C.14-N.13-C.8 | -179.64 | Rigid |
| 26 | C.9-C.8-C.7-C.1211-6-7-8 C.12-C.7-C.8-C.9 | -0.026 | Rigid Ring |
| 27 | C.9-C.8-C.13-N.1413-12-7-8 C.14-C.13-C.8-N.9 | -153.41 | Flexible |
| 28 | C.9-C.8-C.13-O.3332-12-7-8 C.33-C.13-C.8-O.9 | 27.017 | Flexible |
| 29 | C.9-C.10-C.11-C.1211-10-9-8 C.12-C.11-C.10-C.9 | 0.03 | Rigid Ring |
| 30 | C.10-C.9-C.8-C.1312-7-8-9 C.13-C.8-C.9-C.10 | -179.851 | Rigid |
| 31 | C.12-C.7-C.8-C.1312-7-6-11 C.13-C.8-C.7-C.12 | 179.875 | Rigid |
| 32 | C.13-N.14-C.15-C.1615-14-13-12 C.16-N.15-C.14-C.13 | -139.454 | Flexible |
| 33 | C.13-N.14-C.15-C.1716-14-13-12 C.17-N.15-C.14-C.13 | 97.312 | Flexible |
| 34 | N.14-C.15-C.17-C.1817-16-14-13 N.18-C.17-C.15-C.14 | -179.551 | Flexible |
| 35 | N.14-C.15-C.17-C.2019-16-14-13 N.20-C.17-C.15-C.14 | 58.437 | Flexible |
| 36 | C.15-N.14-C.13-O.3332-12-13-14 C.33-N.13-C.14-O.15 | -0.061 | Rigid |
| 37 | C.15-C.17-C.18-O.1918-17-16-14 C.19-C.18-C.17-O.15 | 50.859 | Flexible |
| 38 | C.15-C.17-C.18-O.3231-17-16-14 C.32-C.18-C.17-O.15 | -123.708 | Flexible |
| 39 | C.15-C.17-C.20-C.2827-19-16-14 C.28-C.20-C.17-C.15 | -167.419 | Flexible |
| 40 | C.16-C.15-C.17-C.1817-16-14-15 C.18-C.17-C.15-C.16 | 60.058 | Flexible |
| 41 | C.16-C.15-C.17-C.2019-16-14-15 C.20-C.17-C.15-C.16 | -61.954 | Flexible |
| 42 | C.17-C.18-O.19-C.3433-18-17-16 C.34-C.19-O.18-C.17 | -173.31 | Rigid |
| 43 | C.17-C.20-C.28-C.2322-27-19-16 C.23-C.28-C.20-C.17 | 30.134 | Flexible |
| 44 | C.17-C.20-C.28-C.2726-27-19-16 C.27-C.28-C.20-C.17 | -149.841 | Flexible |
| 45 | C.18-C.17-C.20-C.2827-19-16-17 C.28-C.20-C.17-C.18 | 71.85 | Flexible |
| 46 | O.19-C.18-C.17-C.2019-16-17-18 O.20-C.17-C.18-C.19 | 173.031 | Flexible |
| 47 | C.20-C.17-C.18-O.3231-17-16-19 C.32-C.18-C.17-O.20 | -1.535 | Flexible |
| 48 | C.20-C.28-C.23-C.2423-22-27-19 C.24-C.23-C.28-C.20 | 179.933 | Rigid |
| 49 | C.20-C.28-C.27-C.2625-26-27-19 C.26-C.27-C.28-C.20 | -179.977 | Rigid |
| 50 | C.23-C.24-C.25-C.2625-24-23-22 C.26-C.25-C.24-C.23 | -0.097 | Rigid Ring |
| 51 | C.23-C.24-C.29-N.3029-28-23-22 C.30-C.29-C.24-N.23 | 154.167 | Rigid |
| 52 | C.23-C.24-C.29-N.3130-28-23-22 C.31-C.29-C.24-N.23 | -26.022 | Rigid |
| 53 | C.23-C.28-C.27-C.2625-26-27-22 C.26-C.27-C.28-C.23 | 0.047 | Rigid Ring |
| 54 | C.24-C.23-C.28-C.2726-27-22-23 C.27-C.28-C.23-C.24 | -0.092 | Rigid Ring |
| 55 | C.24-C.25-C.26-C.2726-25-24-23 C.27-C.26-C.25-C.24 | 0.053 | Rigid Ring |
| 56 | C.25-C.24-C.23-C.2827-22-23-24 C.28-C.23-C.24-C.25 | 0.117 | Rigid Ring |
| 57 | C.25-C.24-C.29-N.3029-28-23-24 C.30-C.29-C.24-N.25 | -26.055 | Rigid |
| 58 | C.25-C.24-C.29-N.3130-28-23-24 C.31-C.29-C.24-N.25 | 153.755 | Rigid |
| 59 | C.25-C.26-C.27-C.2827-26-25-24 C.28-C.27-C.26-C.25 | -0.028 | Rigid Ring |
| 60 | C.26-C.25-C.24-C.2928-23-24-25 C.29-C.24-C.25-C.26 | -179.877 | Rigid |
| 61 | C.28-C.23-C.24-C.2928-23-22-27 C.29-C.24-C.23-C.28 | 179.896 | Rigid |
| 62 | O.32-C.18-O.19-C.3433-18-17-31 O.34-C.19-O.18-C.32 | 1.397 | Rigid |
Dihedrals Histogram