1LMW

lmw u-pa structure complexed with egrcmk (glu-gly-arg chloromethyl ketone)

• Total interactions analyzed: 6
• Total true interactions: 3
• Strongest Interaction:
  • Chains: B-D
  • Int. Res.: 74
  • Norm. En. per Res.: -1.2661
• 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	-18.4389	-1.0456	580.343	560.8584	40	13	0	4070	2	3	3
B-D	-11.3304	-2.3773	-79.9834	-93.6911	74	4	1	4557	0	29	29
C-D	-11.8715	1.0791	583.165	572.3726	41	15	0	4549	3	3	3

Interface residues

• A-B: ARG116B, ARG206B, ARG239B, ARG7A, ASN26B, CYS122B, CYS1A, GLN119B, GLN27B, GLN3A, GLU137B, GLU25B, GLY205B, GLY2A, ILE118B, ILE121B, ILE24B, LEU123B, LEU203B, LEU209B, LEU46B, LEU6A, LYS4A, MET157B, MET207B, MET47B, PRO114B, PRO28B, PRO8A, SER115B, SER202B, SER48B, THR117B, THR120B, THR139B, THR208B, THR23B, THR5A, TRP29B, VAL200B
• B-D: ALA104D, ALA96B, ALA96D, ALA98B, ALA98D, ARG217B, ARG217D, ARG35B, ARG35D, ARG37B, ARG37D, ASN101D, ASN145B, ASN145D, ASP148B, ASP148D, ASP60B, ASP60D, ASP93B, ASP93D, ASP97B, ASP97D, GLN192B, GLN192D, GLU175B, GLY216B, GLY218B, GLY218D, GLY37B, GLY37D, HIS100B, HIS100D, HIS37B, HIS37D, HIS57B, HIS57D, HIS91B, HIS91D, HIS99B, HIS99D, ILE60B, ILE60D, ILE89D, LEU150D, LEU90B, LEU90D, LEU97B, LEU97D, LYS143B, LYS143D, LYS61B, LYS61D, LYS92B, LYS92D, PHE59B, PHE59D, PRO60B, PRO60D, SER146B, SER146D, SER95B, SER95D, THR147B, THR147D, THR56B, THR56D, THR97B, THR97D, TYR149B, TYR149D, TYR60B, TYR60D, TYR94B, TYR94D
• C-D: ARG116D, ARG206D, ARG239D, ARG7C, ASN26D, CYS122D, CYS1C, GLN119D, GLN27D, GLN3C, GLN78D, GLU137D, GLU25D, GLY205D, GLY2C, ILE118D, ILE121D, ILE24D, LEU123D, LEU209D, LEU46D, LEU6C, LYS4C, MET157D, MET207D, MET47D, PRO114D, PRO28D, PRO8C, SER115D, SER202D, SER48D, THR117D, THR120D, THR139D, THR208D, THR22D, THR23D, THR5C, TRP29D, VAL200D