1LVM

catalytically active tobacco etch virus protease complexed with product

• Total interactions analyzed: 10
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 60
  • Norm. En. per Res.: -6.3107
• 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	-154.971	-49.6745	-537.244	-741.8895	133	42	7	19057	4	21	39
A-C	-94.2362	-5.388	-279.015	-378.6392	60	16	9	8476	0	5	0
A-E	-48.0087	0.0	-119.888	-167.8967	30	5	6	4519	0	4	0
B-C	0.0	0.0	-0.0003	-0.0003	2	0	0	1	0	0	0
B-D	-72.5981	-5.6855	-258.293	-336.5766	60	19	9	8234	0	5	1

Interface residues

• A-B: ARG105B, ARG108A, ARG108B, ARG159A, ARG159B, ARG9A, ARG9B, ASN115A, ASN115B, ASN12A, ASN12B, ASN171A, ASN171B, ASN174A, ASN174B, ASN176A, ASN176B, ASN177A, ASN177B, ASP10A, ASP10B, ASP127A, ASP127B, CB8.90127-2.24849, CYS110A, CYS110B, CYS130A, CYS130B, GLN117B, GLN145A, GLN145B, GLN150A, GLN150B, GLU106B, GLU107B, GLU2A, GLY-8A, GLY1A, GLY7A, GLY7B, HIS-1A, HIS-2A, HIS-3A, HIS-4A, HIS-5A, HIS-6A, HIS-7A, HIS-7A9, HIS142A, HIS142B, HIS167B, ILE109A, ILE109B, ILE144A, ILE144B, ILE18A, LEU111A, LEU111B, LEU155A, LEU155B, LEU4A, LEU4B, LEU60A, LYS119A, LYS119B, LYS141B, LYS147A, LYS147B, LYS6A, LYS6B, MET121A, MET121B, MET124A, MET124B, PHE116B, PHE132B, PHE5A, PHE5B, PRO133B, PRO13A, PRO13B, PRO154A, PRO154B, PRO8A, PRO8B, SER120A, SER120B, SER122A, SER122B, SER123A, SER123B, SER126A, SER126B, SER129A, SER129B, SER134B, SER135B, SER153A, SER153B, SER15A, SER15B, SER16A, SER170A, SER170B, SER3A, SER3B, THR113A, THR113B, THR114A, THR114B, THR118A, THR118B, THR128A, THR128B, THR131B, THR146A, THR146B, THR158A, THR158B, THR173A, THR173B, THR175A, THR175B, THR17A, TRP143A, TRP143B, TYR11A, TYR11B, TYR178B, VAL112A, VAL112B, VAL125A, VAL125B
• A-C: ALA169A, ALA206A, ARG49A, ARG80A, ASN171A, ASN174A, ASN176A, ASN177A, ASN303C, ASN44A, ASP148A, ASP207A, ASP219A, ASP81A, CYS151A, GLN145A, GLN150A, GLN307C, GLU302C, GLY149A, GLY152A, GLY212A, GLY213A, HIS142A, HIS167A, HIS214A, HIS46A, ILE144A, LEU204A, LEU210A, LEU304C, LEU32A, LYS141A, LYS147A, LYS215A, LYS220A, LYS45A, MET218A, MET82A, PHE139A, PHE172A, PHE179A, PHE217A, PHE306C, PRO221A, SER134A, SER168A, SER170A, SER208A, SER31A, THR146A, THR173A, THR175A, THR180A, THR30A, TRP211A, TYR178A, TYR305C, VAL209A, VAL216A
• A-E: ALA231E, ASN236E, ASN68A, ASP90A, GLN233E, GLN58A, GLU230E, GLY62A, HIS61A, ILE41A, LEU234E, LEU55A, LEU56A, LEU72A, LYS65A, LYS67A, LYS89A, MET235E, MET87A, PHE64A, PHE91A, PRO88A, PRO92A, THR232E, THR54A, THR69A, THR71A, VAL57A, VAL63A, VAL66A
• B-C: GLN307C, LEU4B
• B-D: ALA169B, ARG49B, ARG80B, ASN171B, ASN174B, ASN176B, ASN177B, ASN303D, ASN44B, ASP148B, ASP207B, ASP219B, ASP81B, CYS151B, GLN145B, GLN150B, GLN307D, GLU302D, GLY149B, GLY152B, GLY212B, GLY213B, HIS142B, HIS167B, HIS214B, HIS46B, ILE144B, LEU204B, LEU210B, LEU304D, LEU32B, LYS141B, LYS147B, LYS215B, LYS220B, LYS45B, MET218B, PHE139B, PHE172B, PHE179B, PHE217B, PHE306D, PRO221B, SER134B, SER135B, SER168B, SER170B, SER208B, SER31B, THR146B, THR173B, THR175B, THR180B, THR30B, TRP140B, TRP211B, TYR178B, TYR305D, VAL209B, VAL216B