2QE5

structure of hcv ns5b bound to an anthranilic acid inhibitor

• Total interactions analyzed: 6
• Total true interactions: 4
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 68
  • Norm. En. per Res.: -2.2941
• 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	0.0	-0.8443	-0.8443	8	0	0	94	0	8	3
A-C	-6.2879	-46.0014	-103.709	-155.9983	68	4	0	4377	4	15	29
A-D	-7.7249	-4.8813	-56.0547	-68.661	41	10	0	2350	0	19	7
C-D	0.0	0.0	-1.2704	-1.2704	7	0	0	110	0	8	3

Interface residues

• A-B: ASN110B, GLN514A, GLN514B, GLU437A, GLU437B, LYS106A, LYS106B, SER513A
• A-C: ALA504C, ALA509C, ALA519C, ALA542A, ARG200A, ARG32C, ARG380A, ARG465A, ARG490C, ARG498C, ARG501C, ARG503C, ARG505C, ARG508C, ARG510C, ASN206A, ASN213A, ASN28C, GLN184A, GLN194A, GLN199A, GLN514C, GLU202A, GLU325A, GLU464A, GLY188A, GLY198A, GLY515C, GLY516C, HIS502C, LEU204A, LEU314A, LEU469A, LEU511C, LEU512C, LYS209A, LYS211A, LYS212A, LYS379A, LYS531C, LYS533C, LYS535A, LYS74A, MET187A, PHE203A, PRO214A, PRO496C, PRO538A, SER189A, SER190A, SER210A, SER29C, SER377A, SER506C, SER513C, SER543A, THR207A, THR532C, TRP208A, TYR191A, TYR195A, TYR382A, VAL185A, VAL201A, VAL205A, VAL499C, VAL507C, VAL530C
• A-D: ALA115D, ALA327A, ALA333A, ASN110D, ASN117D, ASN213A, ASP107D, ASP332A, ASP359A, CYS324A, GLN330A, GLU325A, GLU331A, GLU357A, GLY102D, GLY216A, GLY328A, HIS118D, HIS120D, ILE119D, LEU111D, LEU360A, LEU362A, LYS114D, LYS209A, LYS211A, LYS212A, MET215A, PHE101D, PRO214A, PRO356A, SER112D, SER113D, SER121D, SER326A, THR329A, TRP208A, TYR103D, TYR358A, VAL116D, VAL85D
• C-D: ASN110C, GLN514C, GLN514D, GLU437C, GLU437D, LYS106C, LYS106D