Dipole vector (in atomic units): 56.24 -6.51 -71.56
Mass Moments vector: 543.01 324.86 393.07
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| show whole-molecule | ChainID = A | Elongated | CRYSTAL STRUCTURE OF CASPASE-7 IN COMPLEX WITH ACETYL-A CHO | |||||||
|---|---|---|---|---|---|---|---|---|---|---|
| No.Atoms | No.Res. | RM | Pos.Res. | Neg.Res. | Charge | Dipole | Quadrapole | Crg./Nat. | Dip./Nat. | |
| Value | 1840. | 230. | 248.30 | 29. | 32. | -3. | 438. | 1778. | -0.0016 | 0.2382 |
| No.Dev.Units | 0.06 | 0.03 | -0.09 | 0.26 | 0.21 | 0.03 | -0.25 | -0.20 | -0.04 | -0.46 |
| Dipole vector (in atomic units): 56.24 -6.51 -71.56 Mass Moments vector: 543.01 324.86 393.07
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|
| show whole-molecule | ChainID = C | Elongated | CRYSTAL STRUCTURE OF CASPASE-7 IN COMPLEX WITH ACETYL-A CHO | |||||||
|---|---|---|---|---|---|---|---|---|---|---|
| No.Atoms | No.Res. | RM | Pos.Res. | Neg.Res. | Charge | Dipole | Quadrapole | Crg./Nat. | Dip./Nat. | |
| Value | 24. | 3. | 6.56 | 0. | 1. | -2. | 26. | 35. | -0.0833 | 1.0848 |
| No.Dev.Units | -1.48 | -1.49 | -1.69 | -1.47 | -1.36 | 0.16 | -1.24 | -0.73 | -14.37 | 2.53 |
| Dipole vector (in atomic units): -4.02 0.18 3.63 Mass Moments vector: 8.23 12.88 12.40
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