Dipole moment for 4qd6: ITK KINASE DOMAIN IN COMPLEX WITH INHIBITOR COMPOUND

No. of Chains=1Elongated ITK KINASE DOMAIN IN COMPLEX WITH INHIBITOR COMPOUND
No.AtomsNo.Res.RMPos.Res.Neg.Res.ChargeDipoleQuadrapoleCrg./Nat.Dip./Nat.
Value 1944. 244. 320.55 23. 35.-12. 945. 1240.-0.0062 0.4862
No.Dev.Units 0.15 0.13 0.39 -0.10 0.36 -1.14 0.96 -0.36 -0.84 0.41
Dipole vector (in atomic units): 98.61 -117.59 -123.18
Mass Moments vector: 419.04 580.77 641.80
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Bioinformatics and Biological Computing
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