3HW3

the crystal structure of avian influenza virus pa_n in complex with ump

• Total interactions analyzed: 6
• Total true interactions: 4
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 57
  • Norm. En. per Res.: -2.9084
• 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-B	-26.4846	28.8585	-168.151	-165.777	57	16	0	6219	0	20	17
A-D	0.0	0.0	-0.7895	-0.7895	18	0	0	129	0	4	1
B-C	0.0	-12.5199	-64.8069	-77.3268	48	3	2	2450	3	12	13
C-D	0.0	0.0	-0.2065	-0.2065	4	0	0	63	0	3	5

Interface residues

• A-B: ALA20A, ALA20B, ALA87A, ALA87B, ARG82A, ARG82B, ARG84A, ARG84B, ASN92A, ASN92B, ASN96A, ASN96B, ASP27A, ASP27B, ASP83A, ASP83B, CYS95A, CYS95B, GLU18A, GLU18B, GLU23A, GLU23B, GLU26A, GLU26B, GLY25A, GLY25B, GLY81A, GLY81B, LEU106A, LEU106B, LEU16A, LEU16B, LYS102A, LYS102B, LYS19A, LYS19B, LYS22A, LYS22B, LYS29A, MET21A, MET21B, MET86A, MET86B, SER93A, SER93B, THR85A, THR85B, THR89A, THR89B, TRP88A, TRP88B, TYR24A, TYR24B, VAL90A, VAL90B, VAL91A, VAL91B
• A-D: ARG170A, ARG174A, ARG82D, ASN10A, ASN10D, GLU15D, GLU166A, GLU77D, ILE78D, LYS19D, MET12A, MET12D, PHE46A, PHE46D, PHE76D, PRO11A, PRO11D, SER49D
• B-C: ARG170B, ARG170C, ARG174C, ARG75B, ARG75C, ARG82B, ARG82C, ASN10B, ASN10C, ASP164B, ASP50B, CYS39C, CYS45C, GLN7C, GLU166B, GLU166C, GLU43C, GLU77B, GLU77C, HIS52B, HIS74B, HIS74C, ILE13C, ILE171C, ILE78B, ILE78C, ILE94B, LEU109C, LEU16C, LEU42C, MET12B, MET12C, MET47C, PHE46C, PHE51B, PHE53B, PHE76B, PHE76C, PHE9C, PRO11B, PRO11C, SER167B, SER49C, THR40C, TYR112B, TYR48C, VAL44C, VAL90B
• C-D: ASN115C, GLU114C, LYS113C, LYS113D