Dipole moment for 7npa: CRYSTAL STRUCTURE OF THE COENZYME F420-DEPENDENT SULFIT FROM METHANOTHERMOCOCCUS THERMOLITHOTROPHICU

show whole-molecule ChainID = AElongated CRYSTAL STRUCTURE OF THE COENZYME F420-DEPENDENT SULFIT FROM METHANOTHERMOCOCCUS THERMOLIT
No.AtomsNo.Res.RMPos.Res.Neg.Res.ChargeDipoleQuadrapoleCrg./Nat.Dip./Nat.
Value 4869. 618. 700.07 93. 97. -4. 1488. 22401.-0.0008 0.3055
No.Dev.Units 2.64 2.63 2.91 4.08 3.50 -0.10 2.26 5.97 0.10 -0.23
Dipole vector (in atomic units): 166.53 255.06 -56.06
Mass Moments vector: 959.64 808.24 1684.27
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show whole-molecule ChainID = BElongated CRYSTAL STRUCTURE OF THE COENZYME F420-DEPENDENT SULFIT FROM METHANOTHERMOCOCCUS THERMOLIT
No.AtomsNo.Res.RMPos.Res.Neg.Res.ChargeDipoleQuadrapoleCrg./Nat.Dip./Nat.
Value 4863. 618. 697.93 93. 97. -4. 1528. 22161.-0.0008 0.3143
No.Dev.Units 2.64 2.63 2.89 4.08 3.50 -0.10 2.36 5.90 0.10 -0.20
Dipole vector (in atomic units): 99.18 -299.13 43.80
Mass Moments vector: 900.59 819.07 1703.53
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show whole-molecule ChainID = CElongated CRYSTAL STRUCTURE OF THE COENZYME F420-DEPENDENT SULFIT FROM METHANOTHERMOCOCCUS THERMOLIT
No.AtomsNo.Res.RMPos.Res.Neg.Res.ChargeDipoleQuadrapoleCrg./Nat.Dip./Nat.
Value 4862. 618. 696.53 93. 97. -4. 1585. 23002.-0.0008 0.3260
No.Dev.Units 2.64 2.63 2.89 4.08 3.50 -0.10 2.49 6.15 0.10 -0.15
Dipole vector (in atomic units): -179.65 -271.81 -52.40
Mass Moments vector: 920.57 834.39 1680.11
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show whole-molecule ChainID = DElongated CRYSTAL STRUCTURE OF THE COENZYME F420-DEPENDENT SULFIT FROM METHANOTHERMOCOCCUS THERMOLIT
No.AtomsNo.Res.RMPos.Res.Neg.Res.ChargeDipoleQuadrapoleCrg./Nat.Dip./Nat.
Value 4838. 617. 695.45 93. 97. -4. 1523. 22861.-0.0008 0.3149
No.Dev.Units 2.62 2.63 2.88 4.08 3.50 -0.10 2.35 6.11 0.10 -0.19
Dipole vector (in atomic units): -105.35 296.63 38.71
Mass Moments vector: 929.17 861.17 1657.69
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