2PWP

crystal structure of spermidine synthase from plasmodium falciparum in complex with spermidine

• Total interactions analyzed: 3
• Total true interactions: 2
• Strongest Interaction:
  • Chains: B-C
  • Int. Res.: 144
  • Norm. En. per Res.: -4.1639
• 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	-7.5824	-26.5893	-80.153	-114.3248	49	6	3	3779	4	28	30
B-C	-131.0953	-26.9033	-441.61	-599.6086	144	19	10	16035	3	24	19

Interface residues

• A-B: ASP110A, ASP130B, GLN33A, GLU111A, GLU111B, GLU115A, GLU115B, GLU129A, GLU129B, GLU27A, GLU27B, ILE114A, ILE114B, ILE119A, ILE119B, ILE137A, ILE24A, LEU25A, LEU25B, LYS118A, LYS118B, LYS122A, LYS122B, LYS131A, LYS23B, LYS29A, LYS29B, LYS31A, LYS31B, LYS45B, PHE121B, SER117A, SER117B, SER30A, THR112A, THR112B, THR28A, THR28B, TYR120A, TYR120B, TYR128B, TYR26A, TYR26B, TYR32A, VAL113A, VAL116A, VAL116B, VAL35A, VAL37B
• B-C: ALA16B, ALA16C, ALA255B, ALA255C, ALA267B, ALA267C, ALA268B, ALA268C, ALA273B, ALA273C, ALA62B, ALA62C, ASN219B, ASN219C, ASN261B, ASN261C, ASN264B, ASN264C, ASP256B, ASP256C, ASP59B, ASP59C, CYS227B, CYS227C, CYS229B, CYS229C, GLN15B, GLN15C, GLU263B, GLU263C, GLU57B, GLU57C, GLU60B, GLU60C, GLU65B, GLU65C, GLU7B, GLU7C, GLY14B, GLY14C, GLY228B, GLY228C, HIS197B, HIS197C, HIS265B, HIS265C, ILE196B, ILE196C, ILE21B, ILE21C, ILE220B, ILE220C, ILE222B, ILE222C, ILE230C, LEU194B, LEU194C, LEU19B, LEU19C, LEU257B, LEU257C, LEU271B, LEU271C, LEU275B, LEU275C, LEU276B, LEU276C, LYS20B, LYS20C, LYS258B, LYS258C, LYS270B, LYS270C, LYS277B, LYS277C, LYS2B, LYS2C, LYS58B, LYS58C, MET66B, MET66C, PHE17B, PHE17C, PHE269B, PHE269C, PHE274B, PHE274C, PHE38B, PHE38C, PHE5B, PHE5C, PHE61B, PHE61C, PHE8B, PHE8C, PRO13B, PRO13C, PRO223B, PRO223C, PRO226B, PRO226C, PRO272B, PRO272C, SER18B, SER18C, SER193B, SER193C, SER221B, SER221C, SER266B, SER266C, SER40B, SER40C, SER6B, SER6C, SER9B, SER9C, THR224B, THR224C, THR41B, THR41C, THR42B, THR42C, THR56B, TRP12B, TRP12C, TRP195B, TRP195C, TRP4B, TRP4C, TYR225B, TYR225C, TYR259B, TYR259C, TYR260B, TYR260C, TYR262B, TYR262C, TYR43B, TYR43C, TYR63B, TYR63C, VAL198B, VAL198C