3HKV

human poly(adp-ribose) polymerase 10, catalytic fragment in complex with an inhibitor 3-aminobenzamide

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 109
  • Norm. En. per Res.: -1.7472
• 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	-25.3579	87.1836	-252.267	-190.4412	109	10	6	10660	2	26	48

Interface residues

• A-B: ALA893A, ALA899A, ALA899B, ALA962A, ALA962B, ARG869A, ARG869B, ARG871A, ARG871B, ARG875A, ARG875B, ARG904A, ARG904B, ARG909A, ARG909B, ARG961A, ARG961B, ARG966B, ARG974A, ARG974B, ASN818A, ASN819A, ASN903A, ASN903B, ASP896A, ASP896B, ASP976A, ASP976B, ASP993A, ASP993B, CYS876B, CYS898A, CYS907A, CYS907B, GLN862A, GLN862B, GLN863A, GLN863B, GLN864A, GLN864B, GLN874B, GLN995A, GLN995B, GLU866A, GLU866B, GLU870A, GLU870B, GLU877B, GLY901A, GLY901B, GLY908A, GLY917A, GLY917B, GLY959A, HIS858A, HIS858B, HIS900A, HIS900B, HIS992A, HIS992B, ILE897A, ILE990B, LEU860A, LEU860B, LEU861A, LEU861B, LEU867A, LEU867B, LEU872A, LEU872B, LEU949A, LEU949B, LEU960A, LEU960B, LEU965A, LEU965B, LEU972A, LEU972B, LEU973A, LEU973B, LYS916A, LYS916B, PHE902A, PHE902B, PHE906A, PHE906B, PHE991A, PHE991B, PRO859A, PRO859B, PRO892A, PRO895A, PRO895B, PRO963A, PRO963B, SER905A, SER905B, SER977B, THR994A, THR994B, TRP817A, TYR865A, TYR865B, TYR868A, TYR868B, TYR975A, TYR975B, VAL894A, VAL971B