Dipole moment for 1jfz: CRYSTAL STRUCTURE OF MN(II)-COMPLEX OF RNASE III ENDONUCLEASE DOMAIN FROM AQUIFEX AEOLICUS AT

show whole-molecule ChainID = AElongated CRYSTAL STRUCTURE OF MN(II)-COMPLEX OF RNASE III ENDONUCLEASE DOMAIN FROM AQUIFEX A
No.AtomsNo.Res.RMPos.Res.Neg.Res.ChargeDipoleQuadrapoleCrg./Nat.Dip./Nat.
Value 1233. 148. 183.58 23. 22. 1. 528. 2477. 0.0008 0.4281
No.Dev.Units -0.45 -0.52 -0.52 -0.10 -0.30 0.56 -0.04 0.01 0.39 0.21
Dipole vector (in atomic units): -50.45 -94.64 -24.04
Mass Moments vector: 337.24 372.43 225.56
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show whole-molecule ChainID = BElongated CRYSTAL STRUCTURE OF MN(II)-COMPLEX OF RNASE III ENDONUCLEASE DOMAIN FROM AQUIFEX A
No.AtomsNo.Res.RMPos.Res.Neg.Res.ChargeDipoleQuadrapoleCrg./Nat.Dip./Nat.
Value 1247. 149. 184.90 23. 22. 1. 559. 2500. 0.0008 0.4483
No.Dev.Units -0.44 -0.51 -0.51 -0.10 -0.30 0.56 0.04 0.01 0.39 0.28
Dipole vector (in atomic units): 109.89 33.72 18.23
Mass Moments vector: 378.19 319.46 250.24
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