3OTK

structure and mechanisim of core 2 beta1,6-n- acetylglucosaminyltransferase: a metal-ion independent gt-a glycosyltransferase

• Total interactions analyzed: 6
• Total true interactions: 3
• Strongest Interaction:
  • Chains: B-C
  • Int. Res.: 44
  • Norm. En. per Res.: -1.0012
• Hub Node: A(1)

All Interactions

Chains	Hydro. Bond Ener. (kJ/mol)	Elec. Ener. (kJ/mol)	VDW. Ener. (kJ/mol)	Tot. Stab. Ener. (kJ/mol)	#int. res.	# Short cont.	#Hydr. int.	#VDW pairs	#salt bridges	#Pot. fav. elec. int	#Pot. unfav. elec. int
A-B	-33.911	-34.838	560.292	491.543	109	18	0	9117	4	39	36
B-C	0.0	-0.4175	-43.6345	-44.052	44	2	2	2471	0	13	10
C-D	-45.7708	-33.1113	580.093	501.2109	109	14	0	9085	4	39	36

Interface residues

• A-B: ALA349A, ALA349B, ALA367A, ALA367B, ARG231A, ARG231B, ARG328A, ARG328B, ARG393A, ARG393B, ASN340A, ASN340B, ASN348A, ASN348B, ASN365A, ASN365B, ASP343A, ASP343B, ASP346A, ASP346B, ASP362A, ASP362B, CYS235A, CYS235B, GLN394A, GLN394B, GLU228A, GLU228B, GLU239A, GLU239B, GLU243A, GLU243B, GLU245A, GLU245B, GLU331A, GLU331B, GLY366A, GLY366B, HIS395A, HIS395B, HIS396A, HIS396B, ILE329A, ILE329B, LEU233A, LEU344A, LEU344B, LYS224A, LYS224B, LYS232A, LYS232B, LYS234A, LYS234B, LYS279A, LYS279B, LYS341A, LYS341B, LYS355A, LYS355B, MET347A, MET347B, PHE283A, PHE283B, PHE336A, PHE336B, PHE353A, PHE353B, PHE359A, PHE359B, PRO281A, PRO281B, PRO330A, PRO330B, PRO337A, PRO337B, PRO368A, PRO368B, PRO370A, PRO370B, SER236A, SER236B, SER338A, SER338B, SER339A, SER339B, SER345A, SER345B, SER364A, SER364B, THR237A, THR237B, THR244A, THR244B, THR280A, THR280B, TRP356A, TRP356B, TRP390A, TRP390B, TYR342A, TYR342B, TYR358A, TYR358B, TYR369A, TYR369B, VAL354A, VAL354B, VAL363A, VAL363B
• B-C: ALA385C, ASP387C, ASP407C, CYS372B, CYS372C, CYS381C, GLN357B, GLN357C, GLN71B, GLN71C, GLU360C, GLU76B, GLU76C, GLY361C, GLY374B, GLY374C, GLY384C, GLY386C, HIS376B, HIS376C, ILE70C, ILE77B, LEU75B, LEU75C, LEU78B, LYS355C, LYS72B, LYS74B, LYS74C, PHE383C, PRO370C, PRO371C, PRO408C, PRO67C, SER373B, SER373C, THR79B, VAL375B, VAL375C, VAL377C, VAL382C, VAL406B, VAL406C, VAL73C
• C-D: ALA349C, ALA349D, ALA367C, ALA367D, ARG231C, ARG231D, ARG328C, ARG328D, ARG393C, ARG393D, ASN340C, ASN340D, ASN348C, ASN348D, ASN365C, ASN365D, ASP343C, ASP343D, ASP346C, ASP346D, ASP362C, ASP362D, CYS235C, CYS235D, GLN394C, GLN394D, GLU228C, GLU228D, GLU239C, GLU239D, GLU243C, GLU243D, GLU245C, GLU245D, GLU331C, GLU331D, GLY366C, GLY366D, HIS395C, HIS395D, HIS396C, HIS396D, ILE329C, ILE329D, LEU233C, LEU344C, LEU344D, LYS224C, LYS224D, LYS232C, LYS232D, LYS234C, LYS234D, LYS279C, LYS279D, LYS341C, LYS341D, LYS355C, LYS355D, MET347C, MET347D, PHE283C, PHE283D, PHE336C, PHE336D, PHE353C, PHE353D, PHE359C, PHE359D, PRO281C, PRO281D, PRO330C, PRO330D, PRO337C, PRO337D, PRO368C, PRO368D, PRO370C, PRO370D, SER236C, SER236D, SER338C, SER338D, SER339C, SER339D, SER345C, SER345D, SER364C, SER364D, THR237C, THR237D, THR244C, THR244D, THR280C, THR280D, TRP356C, TRP356D, TRP390C, TRP390D, TYR342C, TYR342D, TYR358C, TYR358D, TYR369C, TYR369D, VAL354C, VAL354D, VAL363C, VAL363D