2AHC

chorismate lyase with inhibitor vanilate

• Total interactions analyzed: 6
• Total true interactions: 4
• Strongest Interaction:
  • Chains: A-D
  • Int. Res.: 50
  • Norm. En. per Res.: -3.3661
• 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	0.0	-3.5319	-32.1756	-35.7075	38	0	0	1545	0	14	8
A-C	-10.2741	1.6043	-72.2078	-80.8776	41	22	1	3820	0	12	15
A-D	-25.8997	-22.2505	-120.157	-168.3072	50	4	6	5487	0	14	13
B-D	-8.1208	-22.3709	-151.617	-182.1087	62	12	5	7101	0	21	20

Interface residues

• A-B: ALA105A, ALA160B, ARG37B, ARG76A, ASP21B, ASP26B, ASP83B, GLN107A, GLN23B, GLN40B, GLN41B, GLU52A, GLY110A, GLY42B, GLY53A, LEU106A, LEU109A, LEU118A, LEU163B, LEU24B, LYS108A, LYS111A, LYS43B, MET49A, PRO113A, PRO159B, PRO162B, PRO22B, SER161B, SER46A, THR112A, THR44A, TRP27B, TRP74A, TRP87B, TYR117A, TYR164B, VAL45A
• A-C: ALA19C, ARG12A, ARG141A, ARG143A, ARG145A, ASP127A, ASP21C, ASP26C, GLN23C, GLN57A, GLU130A, GLU16A, GLU16C, GLU62A, GLU63A, ILE129A, ILE131A, ILE131C, ILE17A, ILE17C, ILE60A, LEU152A, LEU20C, LEU24C, LEU25C, LEU29C, LEU64A, LEU66A, LEU67A, LYS15A, LYS69A, PHE128A, PRO18C, PRO22C, PRO61A, PRO65A, PRO68A, SER14A, SER14C, TRP138C, TYR13A
• A-D: ARG72A, ARG72D, GLN107A, GLN107D, GLN57A, GLN57D, GLU103A, GLU103D, GLU52A, GLU52D, GLU56A, GLU56D, GLU59A, GLU70A, GLU70D, GLY101A, GLY101D, GLY53A, GLY53D, LEU104A, LEU104D, LEU99A, LEU99D, LYS108A, LYS108D, LYS149A, LYS149D, LYS69A, LYS69D, PHE54A, PHE54D, PRO68D, PRO95A, PRO95D, SER100A, SER100D, SER71A, SER71D, SER97A, SER97D, THR98A, THR98D, TRP74A, TRP74D, TYR73A, TYR73D, VAL55A, VAL55D, VAL96A, VAL96D
• B-D: ALA105D, ALA19B, ARG116D, ARG126B, ARG143B, ARG145B, ARG76D, ASP127B, ASP21B, ASP26B, GLN107D, GLN23B, GLU103D, GLU16B, GLU31B, GLU39D, GLY101D, GLY110D, GLY115D, ILE129B, ILE131B, ILE17B, LEU104D, LEU106D, LEU109D, LEU114D, LEU118D, LEU146D, LEU20B, LEU24B, LEU25B, LEU28B, LEU29B, LEU30B, LEU99D, LYS108D, LYS111D, LYS15B, LYS36D, LYS43D, PHE119D, PHE128B, PRO102D, PRO113D, PRO18B, PRO22B, SER100D, SER121D, SER122D, SER147D, SER14B, SER46D, THR112D, THR120D, THR123D, THR125B, THR35D, THR44D, TRP27B, TYR117D, VAL45D, VAL47D