2GBG

rat dpp-iv with alkynyl cyanopyrrolidine #2

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 206
  • Norm. En. per Res.: -4.1309
• 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	-76.3959	-130.8431	-643.732	-850.971	206	24	9	22650	6	54	36

Interface residues

• A-B: ALA257A, ALA257B, ALA259A, ALA259B, ALA653A, ALA653B, ALA655A, ALA655B, ALA718A, ALA718B, ALA723A, ALA723B, ALA727A, ALA727B, ALA733A, ALA733B, ALA748A, ALA748B, ARG316A, ARG316B, ARG659A, ARG659B, ARG685A, ARG685B, ARG767A, ARG767B, ASN261B, ASP241A, ASP241B, ASP664A, ASP664B, ASP726A, ASP726B, ASP730A, ASP730B, ASP738A, ASP738B, GLN245A, GLN245B, GLN715A, GLN715B, GLN716A, GLN716B, GLN719A, GLN719B, GLN732A, GLN732B, GLN750A, GLN750B, GLN762A, GLN762B, GLU235A, GLU235B, GLU242A, GLU242B, GLU661A, GLU661B, GLU669A, GLU669B, GLU700A, GLU700B, GLU739A, GLU739B, GLY230B, GLY258A, GLY258B, GLY706A, GLY706B, GLY728A, GLY728B, HIS705A, HIS705B, HIS713A, HIS713B, HIS749A, HIS749B, HIS751A, HIS751B, HIS755A, HIS755B, HIS758A, HIS758B, ILE234A, ILE234B, ILE252A, ILE252B, ILE704A, ILE704B, ILE720A, ILE720B, ILE743A, ILE743B, ILE752A, ILE752B, LEU233A, LEU233B, LEU244A, LEU244B, LEU702A, LEU702B, LEU703A, LEU703B, LEU724A, LEU724B, LYS248A, LYS248B, LYS256A, LYS256B, LYS48A, LYS48B, LYS722A, LYS722B, MET690A, MET690B, MET734A, MET734B, MET756A, MET756B, PHE238A, PHE238B, PHE714A, PHE714B, PHE731A, PHE731B, PHE759A, PHE759B, PRO232A, PRO232B, PRO247A, PRO247B, PRO253A, PRO253B, PRO255A, PRO255B, PRO656A, PRO656B, PRO675A, PRO675B, SER237A, SER237B, SER240A, SER240B, SER243A, SER243B, SER658A, SER658B, SER665A, SER665B, SER691A, SER691B, SER717A, SER717B, SER721A, SER721B, SER745A, SER745B, SER746A, SER746B, SER754A, SER754B, THR249A, THR249B, THR668A, THR668B, THR688A, THR688B, THR707A, THR707B, THR737A, THR737B, THR747A, THR747B, TRP251A, TRP251B, TRP660A, TRP660B, TRP735A, TRP735B, TYR236A, TYR236B, TYR239A, TYR239B, TYR246A, TYR246B, TYR254A, TYR254B, TYR662A, TYR662B, TYR663A, TYR663B, TYR684A, TYR684B, TYR701A, TYR701B, TYR736A, TYR736B, VAL231A, VAL231B, VAL260A, VAL260B, VAL689A, VAL689B, VAL725A, VAL725B, VAL729A, VAL729B