3D9T

ciap1-bir3 in complex with n-terminal peptide from caspase- 9 (atpfqe)

• Total interactions analyzed: 6
• Total true interactions: 4
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 31
  • Norm. En. per Res.: -5.749
• Hub Node: A(3)

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	-14.9063	-5.8317	-125.036	-145.774	53	7	2	4969	0	11	11
A-C	-42.4815	0.0	-135.738	-178.2195	31	6	1	3840	0	0	0
A-D	0.0	0.0	-0.7745	-0.7745	3	0	0	94	0	1	1
B-D	-33.2231	1.2833	-137.876	-169.8159	35	4	1	4308	0	3	3

Interface residues

• A-B: ALA264B, ALA265B, ARG266A, ARG266B, ARG268B, ARG294B, ARG308B, ARG326A, ARG332A, ASN257A, ASN257B, ASN295B, ASP296B, ASP297B, ASP304A, CYS300A, CYS302A, CYS303A, CYS327A, GLN261A, GLN336A, GLU328A, GLY288A, GLY293B, GLY305A, HIS320A, ILE331A, LEU258A, LEU330A, MET260A, MET260B, MET267B, MET271B, MET333A, PHE270B, PHE301A, PHE324A, PHE329A, PRO274B, PRO325A, SER259A, SER259B, SER275B, SER276B, THR262A, THR262B, THR269B, TRP273B, TRP317A, TYR272B, TYR290B, TYR291B, VAL292B
• A-C: ALA1C, ARG294A, ARG308A, ASP296A, ASP297A, ASP304A, ASP314A, ASP315A, CYS309A, GLU311A, GLU319A, GLY305A, GLY306A, HIS320A, LEU284A, LEU307A, LYS299A, LYS322A, PHE289A, PHE324A, PHE4C, PRO316A, PRO3C, SER312A, THR2C, TRP310A, TRP323A, VAL279A, VAL292A, VAL298A, VAL318A
• A-D: ARG326A, GLU6D, PHE4D
• B-D: ALA1D, ARG294B, ARG308B, ASP296B, ASP297B, ASP304B, ASP314B, ASP315B, CYS300B, CYS309B, GLN5D, GLU311B, GLU319B, GLU6D, GLY305B, GLY306B, HIS320B, LEU284B, LEU307B, LYS299B, LYS322B, PHE289B, PHE324B, PHE4D, PRO316B, PRO3D, THR2D, TRP310B, TRP323B, TYR290B, TYR291B, VAL279B, VAL292B, VAL298B, VAL318B