1LVB

catalytically inactive tobacco etch virus protease complexed with substrate

• Total interactions analyzed: 6
• Total true interactions: 3
• Strongest Interaction:
  • Chains: B-D
  • Int. Res.: 76
  • Norm. En. per Res.: -6.5815
• Hub Node: A(2)

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-C	-132.4561	-5.3336	-358.139	-495.9287	76	20	10	10631	0	5	0
A-B	-12.2726	-6.4099	-127.355	-146.0376	72	6	1	5937	0	12	8
B-D	-137.0359	-5.7489	-357.41	-500.1949	76	22	10	10665	0	5	1

Interface residues

• A-C: ALA151A, ALA169A, ALA206A, ARG49A, ARG50A, ARG80A, ASN171A, ASN174A, ASN176A, ASN177A, ASN23A, ASN303C, ASN44A, ASP136A, ASP148A, ASP207A, ASP81A, GLN145A, GLN150A, GLN307C, GLU24A, GLU302C, GLY149A, GLY152A, GLY212A, GLY213A, GLY309C, HIS142A, HIS167A, HIS20A, HIS214A, HIS28A, HIS46A, ILE144A, LEU204A, LEU210A, LEU21A, LEU304C, LEU32A, LEU47A, LYS141A, LYS147A, LYS215A, LYS220A, LYS45A, PHE139A, PHE172A, PHE179A, PHE217A, PHE306C, PRO221A, SER134A, SER135A, SER153A, SER168A, SER170A, SER208A, SER219A, SER308C, SER31A, THR146A, THR173A, THR175A, THR180A, THR22A, THR29A, THR301C, THR30A, THR310C, TRP143A, TRP211A, TYR178A, TYR305C, TYR33A, VAL209A, VAL216A
• A-B: ARG9A, ARG9B, ASN115A, ASN115B, ASN12A, ASN12B, ASP10A, ASP10B, ASP127A, ASP127B, CYS110A, CYS110B, GLN117A, GLN117B, GLN58A, GLN58B, GLY62A, GLY62B, HIS61A, HIS61B, ILE14A, ILE14B, LEU60A, LEU60B, LYS119A, LYS119B, LYS97A, LYS97B, PHE116A, PHE116B, PRO13A, PRO13B, PRO8A, PRO8B, PRO92A, PRO92B, PRO93A, PRO93B, PRO95A, PRO95B, SER120A, SER120B, SER122A, SER122B, SER123A, SER123B, SER126A, SER126B, SER15A, SER15B, SER16A, SER16B, SER59A, SER59B, THR113A, THR113B, THR114A, THR114B, THR118A, THR118B, THR128A, THR128B, THR17A, THR17B, TYR11A, TYR11B, VAL112A, VAL112B, VAL125A, VAL125B, VAL63A, VAL63B
• B-D: ALA151B, ALA169B, ALA206B, ARG49B, ARG50B, ARG80B, ASN171B, ASN174B, ASN176B, ASN177B, ASN23B, ASN303D, ASN44B, ASP136B, ASP148B, ASP207B, ASP81B, GLN145B, GLN150B, GLN307D, GLU24B, GLU302D, GLY149B, GLY152B, GLY212B, GLY213B, GLY309D, HIS142B, HIS167B, HIS20B, HIS214B, HIS28B, HIS46B, ILE144B, LEU204B, LEU210B, LEU21B, LEU304D, LEU32B, LEU47B, LYS141B, LYS147B, LYS215B, LYS220B, LYS45B, PHE139B, PHE172B, PHE179B, PHE217B, PHE306D, PRO221B, SER134B, SER135B, SER153B, SER168B, SER170B, SER208B, SER219B, SER308D, SER31B, THR146B, THR173B, THR175B, THR180B, THR22B, THR29B, THR301D, THR30B, THR310D, TRP143B, TRP211B, TYR178B, TYR305D, TYR33B, VAL209B, VAL216B