3TSI

structure of the parainfluenza virus 5 (piv5) hemagglutinin- neuraminidase (hn) stalk domain

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 93
  • Norm. En. per Res.: -2.5145
• 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	-8.7499	0.0	-225.103	-233.8529	93	6	23	10550	0	0	5
A-C	-8.1911	0.0	-207.25	-215.4411	87	3	24	10402	0	0	6
A-D	0.0	0.0	-5.0924	-5.0924	34	0	0	1082	0	0	1
B-C	0.0	0.0	-2.5159	-2.5159	27	0	0	706	0	0	1
B-D	-9.0514	0.0	-218.433	-227.4844	93	12	24	10584	0	0	5
C-D	0.0	0.0	-160.962	-160.962	85	6	18	8634	0	0	5

Interface residues

• A-B: ALA72A, ALA72B, ALA80A, ALA80B, ALA82A, ALA82B, ALA97A, ALA97B, ASN66A, ASN66B, ASN67A, ASN67B, ASN73A, ASN73B, ASN78A, ASN78B, ASP63A, ASP63B, ASP88A, ASP88B, GLN102A, GLN102B, GLN74A, GLN74B, GLN86A, GLN86B, GLU91A, GLU91B, GLY57A, GLY57B, GLY59B, ILE61A, ILE61B, ILE68A, ILE68B, ILE75A, ILE75B, ILE76A, ILE76B, ILE98A, ILE98B, LEU101A, LEU101B, LEU58A, LEU58B, LEU64A, LEU64B, LEU65A, LEU65B, LEU69A, LEU69B, LEU83A, LEU83B, LEU85A, LEU85B, LEU87A, LEU87B, LEU90A, LEU90B, LEU94A, LEU94B, LEU95A, LEU95B, LYS99A, LYS99B, PRO54A, PRO84A, PRO84B, SER100A, SER100B, SER53A, SER56A, SER60A, SER70A, SER70B, SER79A, SER79B, SER92A, SER92B, THR103B, THR62A, THR62B, THR89A, THR89B, THR93A, THR93B, THR96A, THR96B, TYR77A, TYR77B, VAL71A, VAL71B, VAL81B
• A-C: ALA72A, ALA72C, ALA80A, ALA82A, ALA82C, ALA97A, ALA97C, ASN66A, ASN66C, ASN67A, ASN67C, ASN73A, ASN73C, ASN78A, ASN78C, ASP63A, ASP63C, ASP88A, ASP88C, GLN102A, GLN74A, GLN74C, GLN86A, GLN86C, GLU91A, GLU91C, GLY57A, GLY59A, GLY59C, ILE61A, ILE61C, ILE68A, ILE68C, ILE75A, ILE75C, ILE76A, ILE76C, ILE98A, ILE98C, LEU101A, LEU101C, LEU58A, LEU58C, LEU64A, LEU64C, LEU65A, LEU65C, LEU69A, LEU69C, LEU83A, LEU83C, LEU85A, LEU85C, LEU87A, LEU87C, LEU90A, LEU90C, LEU94A, LEU94C, LEU95A, LEU95C, LYS99A, LYS99C, PRO84A, PRO84C, SER100A, SER100C, SER60C, SER70A, SER70C, SER79A, SER79C, SER92A, SER92C, THR62A, THR62C, THR89A, THR89C, THR93A, THR93C, THR96A, THR96C, TYR77A, TYR77C, VAL71A, VAL71C, VAL81A
• A-D: ALA72A, ALA72D, ALA97A, ALA97D, GLN86A, GLU91A, GLU91D, ILE61A, ILE61D, ILE68A, ILE68D, ILE75A, ILE75D, ILE76A, ILE76D, ILE98A, ILE98D, LEU101A, LEU101D, LEU58A, LEU64A, LEU64D, LEU65A, LEU65D, LEU83A, LEU83D, LEU87A, LEU87D, LEU90A, LEU90D, LEU94A, LEU94D, SER79A, SER79D
• B-C: ALA72B, ALA72C, GLU91C, ILE61B, ILE61C, ILE68B, ILE68C, ILE75B, ILE75C, ILE76C, ILE98B, ILE98C, LEU101B, LEU101C, LEU58B, LEU65B, LEU65C, LEU83B, LEU83C, LEU87B, LEU87C, LEU90B, LEU90C, LEU94B, LEU94C, SER79B, SER79C
• B-D: ALA72B, ALA72D, ALA80B, ALA80D, ALA82B, ALA82D, ALA97B, ALA97D, ASN66B, ASN66D, ASN67B, ASN67D, ASN73B, ASN73D, ASN78B, ASN78D, ASP105D, ASP63B, ASP63D, ASP88B, ASP88D, GLN102B, GLN102D, GLN74B, GLN74D, GLN86B, GLN86D, GLU91B, GLU91D, GLY57B, GLY59D, ILE61B, ILE61D, ILE68B, ILE68D, ILE75B, ILE75D, ILE76B, ILE76D, ILE98B, ILE98D, LEU101B, LEU101D, LEU58B, LEU58D, LEU64B, LEU64D, LEU65B, LEU65D, LEU69B, LEU69D, LEU83B, LEU83D, LEU85B, LEU85D, LEU87B, LEU87D, LEU90B, LEU90D, LEU94B, LEU94D, LEU95B, LEU95D, LYS99B, LYS99D, PRO84B, PRO84D, SER100B, SER100D, SER56B, SER60B, SER60D, SER70B, SER70D, SER79B, SER79D, SER92B, SER92D, THR103B, THR103D, THR62B, THR62D, THR89B, THR89D, THR93B, THR93D, THR96B, THR96D, TYR77B, TYR77D, VAL71B, VAL71D, VAL81D
• C-D: ALA72C, ALA72D, ALA80C, ALA80D, ALA82C, ALA82D, ALA97C, ALA97D, ASN66C, ASN66D, ASN67C, ASN67D, ASN73C, ASN73D, ASN78C, ASN78D, ASP105D, ASP63D, ASP88C, ASP88D, GLN102C, GLN74C, GLN74D, GLN86C, GLN86D, GLU91C, GLU91D, GLY57C, ILE61C, ILE61D, ILE68C, ILE68D, ILE75C, ILE75D, ILE76C, ILE76D, ILE98C, ILE98D, LEU101C, LEU101D, LEU58C, LEU64C, LEU64D, LEU65C, LEU65D, LEU69C, LEU69D, LEU83C, LEU83D, LEU85C, LEU85D, LEU87C, LEU87D, LEU90C, LEU90D, LEU94C, LEU94D, LEU95C, LEU95D, LYS99C, LYS99D, PRO84C, PRO84D, SER100D, SER104D, SER60D, SER70C, SER70D, SER79C, SER79D, SER92C, SER92D, THR62C, THR62D, THR89C, THR89D, THR93C, THR93D, THR96C, THR96D, TYR77C, TYR77D, VAL71C, VAL71D, VAL81C