Dipole vector (in atomic units): -18.25 -4.11 -92.52
Mass Moments vector: 542.56 489.64 600.09
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| show whole-molecule | ChainID = A | Spherical | CRYPTOCOCCUS NEOFORMANS THYMIDYLATE SYNTHASE COMPLEXED AND AN ANTIFOLATE | |||||||
|---|---|---|---|---|---|---|---|---|---|---|
| No.Atoms | No.Res. | RM | Pos.Res. | Neg.Res. | Charge | Dipole | Quadrapole | Crg./Nat. | Dip./Nat. | |
| Value | 2427. | 305. | 315.21 | 36. | 41. | -4. | 453. | 1907. | -0.0016 | 0.1868 |
| No.Dev.Units | 0.56 | 0.54 | 0.35 | 0.68 | 0.66 | -0.10 | -0.21 | -0.16 | -0.04 | -0.65 |
| Dipole vector (in atomic units): -18.25 -4.11 -92.52 Mass Moments vector: 542.56 489.64 600.09
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|
| show whole-molecule | ChainID = B | Spherical | CRYPTOCOCCUS NEOFORMANS THYMIDYLATE SYNTHASE COMPLEXED AND AN ANTIFOLATE | |||||||
|---|---|---|---|---|---|---|---|---|---|---|
| No.Atoms | No.Res. | RM | Pos.Res. | Neg.Res. | Charge | Dipole | Quadrapole | Crg./Nat. | Dip./Nat. | |
| Value | 2431. | 305. | 315.95 | 36. | 41. | -4. | 452. | 3629. | -0.0016 | 0.1860 |
| No.Dev.Units | 0.57 | 0.54 | 0.36 | 0.68 | 0.66 | -0.10 | -0.22 | 0.35 | -0.04 | -0.65 |
| Dipole vector (in atomic units): -57.72 -71.72 -19.63 Mass Moments vector: 571.04 462.60 598.62
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