3H5D

dihydrodipicolinate synthase from drug-resistant streptococcus pneumoniae

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 82
  • Norm. En. per Res.: -3.448
• 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	-1.5235	-5.2074	-6.7309	8	1	0	273	0	5	6
A-C	-23.9549	-50.7774	-208.0	-282.7323	82	28	6	9201	2	24	17
A-D	0.0	0.0	-0.1077	-0.1077	7	0	0	36	0	8	15
B-C	0.0	-10.3927	-2.3065	-12.6992	11	0	0	110	1	5	10
B-D	0.0	1.4992	-454.837	-453.3378	138	33	9	17635	0	31	42

Interface residues

• A-B: ASP22B, ASP231A, GLU21B, GLY23B, HIS20B, LYS233A, LYS234A, SER24B
• A-C: ALA174A, ALA174C, ALA177A, ALA177C, ALA200A, ALA200C, ALA205A, ALA205C, ALA226A, ALA226C, ALA228A, ALA228C, ALA235A, ALA235C, ALA236A, ALA236C, ALA237A, ALA237C, ARG240A, ARG240C, ASN175A, ASN175C, ASN202A, ASN202C, ASN247A, ASN247C, ASP196A, ASP196C, ASP231A, ASP231C, GLN239A, GLN239C, GLU181A, GLU181C, GLU229A, GLU229C, GLY195A, GLY195C, GLY204A, GLY204C, HIS182A, HIS182C, HIS199A, HIS199C, ILE180A, ILE180C, ILE189C, ILE227A, ILE227C, ILE238A, ILE238C, ILE243A, ILE243C, LEU173A, LEU173C, LEU179A, LEU179C, LEU203A, LEU203C, LYS183A, LYS183C, LYS233A, LYS233C, LYS241A, LYS241C, MET176A, MET176C, MET201A, MET201C, MET232A, MET232C, PHE198A, PHE198C, PHE242A, PHE242C, PRO244A, PRO244C, SER172C, SER230A, SER230C, TYR178A, TYR178C
• A-D: ARG89D, ASP218A, GLU100D, GLU222A, HIS40A, LYS234A, LYS96D
• B-C: ASP28B, GLN4C, GLU185C, GLU186C, GLU8C, HIS20B, LYS71B, LYS7C, PHE27B, PRO31B, TYR3C
• B-D: ALA128B, ALA128D, ALA256B, ALA256D, ALA279B, ALA279D, ALA48B, ALA48D, ALA52B, ALA52D, ARG145B, ARG145D, ARG273B, ARG273D, ARG89B, ARG89D, ASN115B, ASN115D, ASN86B, ASN86D, ASP22B, ASP87B, ASP87D, ASP90B, ASP90D, GLN119B, GLN119D, GLN124B, GLN124D, GLU120B, GLU120D, GLU53B, GLU53D, GLY121B, GLY121D, GLY144B, GLY144D, GLY23B, GLY49B, GLY49D, GLY82B, GLY82D, GLY84B, GLY84D, HIS125B, HIS125D, ILE110B, ILE110D, ILE129B, ILE129D, ILE142B, ILE142D, ILE92B, ILE92D, LEU108B, LEU108D, LEU274B, LEU274D, LEU276B, LEU276D, LEU46B, LEU46D, LEU57B, LEU57D, LYS116B, LYS116D, LYS127B, LYS127D, LYS168B, LYS168D, MET122B, MET122D, PHE126B, PHE126D, PHE250B, PHE250D, PRO112B, PRO112D, PRO117B, PRO117D, PRO143B, PRO143D, PRO253B, PRO253D, PRO255B, PRO255D, PRO275B, PRO275D, PRO278B, PRO278D, PRO280B, PRO280D, PRO55B, PRO55D, SER118B, SER118D, SER251B, SER251D, SER254B, SER254D, SER54B, SER54D, SER91B, SER91D, THR272B, THR272D, THR50B, THR50D, THR51B, THR51D, THR56B, THR56D, THR58B, THR58D, THR85B, THR85D, THR88B, THR88D, TYR113B, TYR113D, TYR114B, TYR114D, TYR123B, TYR123D, TYR140B, TYR140D, TYR252B, TYR252D, VAL111B, VAL111D, VAL146B, VAL146D, VAL147B, VAL147D, VAL148B, VAL148D, VAL277B, VAL277D