Dipole moment for 3gsb: CRYSTAL STRUCTURE OF GLUTAMATE-1-SEMIALDEHYDE AMINOMUTA WITH GABACULINE

show whole-molecule ChainID = AElongated CRYSTAL STRUCTURE OF GLUTAMATE-1-SEMIALDEHYDE AMINOMUTA WITH GABACULINE
No.AtomsNo.Res.RMPos.Res.Neg.Res.ChargeDipoleQuadrapoleCrg./Nat.Dip./Nat.
Value 3201. 427. 405.14 36. 48.-12. 1258. 4208.-0.0037 0.3930
No.Dev.Units 1.22 1.35 0.95 0.68 1.02 -1.14 1.71 0.52 -0.41 0.08
Dipole vector (in atomic units): 196.93 46.47 166.36
Mass Moments vector: 583.23 834.48 663.88
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show whole-molecule ChainID = BSpherical CRYSTAL STRUCTURE OF GLUTAMATE-1-SEMIALDEHYDE AMINOMUTA WITH GABACULINE
No.AtomsNo.Res.RMPos.Res.Neg.Res.ChargeDipoleQuadrapoleCrg./Nat.Dip./Nat.
Value 3201. 427. 404.38 36. 48.-12. 1259. 1459.-0.0037 0.3933
No.Dev.Units 1.22 1.35 0.95 0.68 1.02 -1.14 1.71 -0.30 -0.41 0.08
Dipole vector (in atomic units): -212.26 -21.05 -152.35
Mass Moments vector: 737.78 664.19 697.31
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