3OZG

crystal structure of plasmodium falciparum hypoxanthine-guanine- xanthine phosphoribosyltransferase in complex with s-serme-immh phosphonate

• Total interactions analyzed: 6
• Total true interactions: 2
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 136
  • Norm. En. per Res.: -3.6835
• 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	-59.1441	-122.3967	-319.413	-500.9538	136	7	8	13740	6	78	79
C-D	-29.1382	44.0272	-213.977	-199.088	92	9	3	8586	0	26	37

Interface residues

• A-B: ALA34A, ALA34B, ALA85A, ALA85B, ALA98A, ALA98B, ARG112A, ARG112B, ARG210A, ARG210B, ARG80A, ARG80B, ARG92A, ARG92B, ASN47A, ASN47B, ASN95A, ASN95B, ASP131A, ASP131B, ASP204A, ASP204B, ASP211A, ASP211B, ASP213A, ASP213B, CYS134A, CYS134B, CYS74A, CYS74B, GLU100A, GLU100B, GLU108A, GLU108B, GLU126A, GLU126B, GLU130A, GLU130B, GLU207A, GLU207B, GLU69A, GLY107A, GLY107B, GLY78A, GLY78B, GLY81A, GLY81B, HIS109A, HIS109B, HIS35A, HIS35B, HIS71A, HIS71B, HIS94A, HIS94B, ILE127A, ILE127B, ILE208A, ILE208B, ILE32A, ILE32B, ILE72A, ILE72B, LEU105A, LEU105B, LEU132B, LEU135A, LEU135B, LEU212A, LEU212B, LEU76A, LEU76B, LEU87A, LEU87B, LEU90A, LEU90B, LYS103A, LYS103B, LYS114A, LYS114B, LYS225A, LYS225B, LYS37A, LYS37B, LYS38A, LYS38B, LYS51A, LYS51B, LYS77A, LYS77B, LYS88A, LYS88B, MET31A, MET31B, PHE106A, PHE106B, PHE209A, PHE209B, PHE83A, PHE83B, PRO104A, PRO104B, PRO33A, PRO33B, SER102A, SER102B, SER129A, SER129B, SER202A, SER202B, SER79B, SER91A, SER91B, SER97A, SER97B, THR101A, THR101B, THR84A, THR84B, TYR110A, TYR110B, TYR226A, TYR226B, TYR36A, TYR36B, TYR39A, TYR39B, TYR96A, TYR96B, VAL111A, VAL111B, VAL113B, VAL128A, VAL128B, VAL99A, VAL99B
• C-D: ALA34C, ALA34D, ALA58C, ALA58D, ARG53C, ARG53D, ARG92C, ASN20C, ASN20D, ASN47C, ASN47D, ASN52C, ASN52D, ASP15C, ASP15D, ASP213C, ASP213D, ASP22C, ASP23C, ASP23D, ASP26C, ASP26D, ASP28C, ASP28D, ASP60C, ASP60D, CYS215D, GLU55C, GLU55D, GLY190C, GLY190D, GLY24C, GLY24D, GLY48C, GLY48D, HIS214C, HIS214D, HIS89C, HIS89D, ILE32C, ILE32D, ILE50C, ILE50D, ILE54C, ILE54D, ILE93C, ILE93D, LEU27C, LEU27D, LEU44C, LEU44D, LEU57C, LEU57D, LYS37C, LYS37D, LYS51C, LYS51D, LYS56C, LYS56D, LYS62C, LYS63C, LYS63D, MET31C, MET31D, PHE14C, PHE14D, PHE18C, PHE18D, PHE191C, PHE191D, PHE30C, PHE30D, PRO16C, PRO16D, PRO46C, PRO46D, SER29C, SER29D, TYR25C, TYR25D, TYR59C, TYR59D, VAL17C, VAL17D, VAL19C, VAL19D, VAL43C, VAL43D, VAL45C, VAL45D, VAL49C, VAL49D