Dipole vector (in atomic units): -64.96 -96.02 141.69
Mass Moments vector: 859.81 650.14 989.30
Open a larger Jmol window.
| show whole-molecule | ChainID = A | Elongated | CRYSTAL STRUCTURE OF MOUSE ACETYLCHOLINESTERASE INHIBIT DIISOPROPYL FLUOROPHOSPHATE (DFP) | |||||||
|---|---|---|---|---|---|---|---|---|---|---|
| No.Atoms | No.Res. | RM | Pos.Res. | Neg.Res. | Charge | Dipole | Quadrapole | Crg./Nat. | Dip./Nat. | |
| Value | 4175. | 534. | 487.70 | 45. | 53. | -9. | 879. | 5204. | -0.0022 | 0.2106 |
| No.Dev.Units | 2.05 | 2.07 | 1.50 | 1.21 | 1.27 | -0.75 | 0.81 | 0.82 | -0.13 | -0.56 |
| Dipole vector (in atomic units): -64.96 -96.02 141.69 Mass Moments vector: 859.81 650.14 989.30
Open a larger Jmol window.
|
| show whole-molecule | ChainID = B | Spherical | CRYSTAL STRUCTURE OF MOUSE ACETYLCHOLINESTERASE INHIBIT DIISOPROPYL FLUOROPHOSPHATE (DFP) | |||||||
|---|---|---|---|---|---|---|---|---|---|---|
| No.Atoms | No.Res. | RM | Pos.Res. | Neg.Res. | Charge | Dipole | Quadrapole | Crg./Nat. | Dip./Nat. | |
| Value | 4151. | 531. | 483.23 | 44. | 52. | -9. | 809. | 3164. | -0.0022 | 0.1950 |
| No.Dev.Units | 2.03 | 2.05 | 1.47 | 1.15 | 1.22 | -0.75 | 0.64 | 0.21 | -0.13 | -0.62 |
| Dipole vector (in atomic units): -65.58 135.00 -76.67 Mass Moments vector: 825.45 714.72 953.62
Open a larger Jmol window.
|
Press here for list of table captions and database averages.
Return to Dipole Query Page/