2YA8

crystal structure of streptococcus pneumoniae nana (tigr4) in complex with oseltamivir carboxylate

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 132
  • Norm. En. per Res.: -2.5278
• Hub Node: A(1)

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	-54.7595	-8.6421	-270.268	-333.6696	132	14	1	11478	1	79	84

Interface residues

• A-B: ALA437B, ALA457A, ALA457B, ALA545A, ALA545B, ALA603B, ALA606A, ALA606B, ALA657A, ALA657B, ARG451A, ARG451B, ARG514A, ARG514B, ARG590A, ARG590B, ARG611A, ARG611B, ASN578A, ASN578B, ASN579A, ASN579B, ASN608A, ASN608B, ASN610A, ASN610B, ASN624A, ASN624B, ASN625A, ASN625B, ASP470A, ASP470B, ASP546A, ASP546B, ASP609A, ASP609B, ASP661A, ASP661B, ASP669A, ASP669B, GLN433A, GLN433B, GLN612A, GLN612B, GLN616A, GLN616B, GLU435A, GLU435B, GLU436A, GLU436B, GLU452A, GLU452B, GLU454A, GLU454B, GLU605A, GLU605B, GLU667A, GLU667B, GLY453A, GLY453B, GLY456A, GLY456B, GLY604B, HIS566A, HIS582A, HIS582B, HIS619A, HIS619B, ILE441B, ILE448A, ILE448B, ILE618A, ILE618B, ILE670A, ILE670B, LEU449A, LEU449B, LYS434A, LYS434B, LYS439A, LYS439B, LYS440A, LYS440B, LYS455A, LYS455B, LYS549A, LYS549B, LYS617A, LYS617B, LYS660A, LYS660B, LYS668A, LYS668B, MET548A, MET548B, MET623A, MET623B, PRO469A, PRO469B, SER431A, SER431B, SER432A, SER432B, SER581A, SER581B, SER620A, SER620B, SER621A, SER621B, SER659A, SER659B, THR622A, THR622B, THR658A, THR658B, THR665A, THR665B, TRP547A, TRP547B, TRP666A, TRP666B, TYR450A, TYR450B, TYR593B, VAL580A, VAL580B, VAL607A, VAL607B, VAL613A, VAL613B, VAL664A, VAL664B