Number of bonds in different types of bonds and the sum of BO for each type in RBD with BL cutoff of 2.5 Å.
Bond type | Sum of BO of type | No. of Bonds |
---|---|---|
C–H | 0.4074 | 1 |
N–C | 61.6410 | 140 |
N–H | 0.3395 | 1 |
N⋯H | 0.2297 | 4 |
O–H | 0.2555 | 1 |
O⋯H | 2.9788 | 89 |
S–S | 0.3324 | 2 |
Total | 66.1843 | 238 |