3OTH

crystal structure of calg1, calicheamicin glycostyltransferase, tdp and calicheamicin alpha3i bound form

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 131
  • Norm. En. per Res.: -1.7058
• 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	-35.2904	-13.5006	-174.674	-223.465	131	6	12	8151	10	32	43

Interface residues

• A-B: ALA206B, ALA213A, ALA213B, ALA221A, ALA221B, ALA23A, ALA23B, ALA26A, ALA26B, ALA27A, ALA27B, ALA284A, ALA284B, ALA307A, ALA307B, ALA361A, ALA361B, ALA363A, ALA363B, ALA365A, ALA365B, ALA367A, ALA367B, ALA368A, ALA368B, ALA371A, ALA371B, ALA372A, ALA372B, ARG201A, ARG201B, ARG218A, ARG218B, ARG222A, ARG222B, ARG25A, ARG25B, ARG360A, ARG360B, ARG364A, ARG364B, ARG381A, ARG381B, ASP210A, ASP210B, ASP219A, ASP219B, ASP253A, ASP253B, ASP290A, ASP290B, ASP377A, ASP377B, GLN208A, GLN208B, GLU207A, GLU207B, GLU357A, GLU357B, GLU369A, GLU369B, GLU378A, GLU378B, GLY209A, GLY209B, GLY28A, GLY28B, GLY306A, GLY306B, GLY308A, GLY308B, GLY362A, GLY362B, GLY375A, GLY375B, HIS288A, HIS288B, ILE370A, ILE370B, LEU211A, LEU211B, LEU215A, LEU215B, LEU224A, LEU224B, LEU285A, LEU285B, LEU286A, LEU286B, LEU291A, LEU291B, LEU305A, LEU305B, LEU354A, LEU354B, LEU46B, LYS45A, LYS45B, PRO212A, PRO212B, PRO223A, PRO223B, PRO281A, PRO281B, PRO287A, PRO287B, PRO374A, PRO374B, PRO376A, PRO376B, SER185A, SER216A, SER216B, SER217A, SER217B, SER358A, SER358B, THR220A, THR220B, TRP214A, TRP214B, VAL203A, VAL203B, VAL225A, VAL225B, VAL289A, VAL289B, VAL309A, VAL309B, VAL366A, VAL366B