Dipole vector (in atomic units): 57.30 -78.48 124.56
Mass Moments vector: 409.42 549.99 414.25
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| show whole-molecule | ChainID = A | Spherical | CRYSTAL STRUCTURE OF SETDB1 WITH A MODIFIED H3 PEPTIDE | |||||||
|---|---|---|---|---|---|---|---|---|---|---|
| No.Atoms | No.Res. | RM | Pos.Res. | Neg.Res. | Charge | Dipole | Quadrapole | Crg./Nat. | Dip./Nat. | |
| Value | 1747. | 215. | 267.02 | 35. | 27. | 9. | 759. | 6522. | 0.0052 | 0.4343 |
| No.Dev.Units | -0.02 | -0.07 | 0.03 | 0.62 | -0.05 | 1.60 | 0.52 | 1.22 | 1.15 | 0.23 |
| Dipole vector (in atomic units): 57.30 -78.48 124.56 Mass Moments vector: 409.42 549.99 414.25
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|
| show whole-molecule | ChainID = B | Elongated | CRYSTAL STRUCTURE OF SETDB1 WITH A MODIFIED H3 PEPTIDE | |||||||
|---|---|---|---|---|---|---|---|---|---|---|
| No.Atoms | No.Res. | RM | Pos.Res. | Neg.Res. | Charge | Dipole | Quadrapole | Crg./Nat. | Dip./Nat. | |
| Value | 47. | 8. | 15.36 | 2. | -0. | 2. | 38. | 95. | 0.0426 | 0.8118 |
| No.Dev.Units | -1.46 | -1.45 | -1.64 | -1.35 | -1.42 | 0.69 | -1.21 | -0.71 | 7.71 | 1.57 |
| Dipole vector (in atomic units): -2.81 -4.29 6.07 Mass Moments vector: 17.24 12.17 40.96
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