1VM6

crystal structure of dihydrodipicolinate reductase (tm1520) from thermotoga maritima at 2.27 a resolution

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: A-D
  • Int. Res.: 102
  • Norm. En. per Res.: -5.4591
• 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	-4.9501	-21.8601	-57.7707	-84.5809	37	3	2	2469	3	8	14
A-C	-77.9376	-62.2246	-224.877	-365.0392	84	12	5	8608	3	50	22
A-D	-172.1235	-63.075	-321.631	-556.8294	102	19	10	12664	2	39	22
B-C	-155.1786	-51.2135	-343.422	-549.8141	117	23	13	14474	2	42	26
B-D	-85.0336	-66.3183	-211.347	-362.6989	84	12	5	8271	4	44	21
C-D	0.0	-22.215	-59.0476	-81.2626	43	2	2	2448	3	11	18

Interface residues

• A-B: ALA181A, ALA181B, ARG180A, ARG180B, ARG184A, ARG184B, ASP163A, ASP163B, GLN14A, GLU22B, GLY158A, GLY158B, GLY159A, GLY159B, GLY162A, GLY162B, HIS127A, HIS128A, HIS128B, HIS179A, HIS179B, ILE182A, ILE182B, LYS178A, LYS178B, LYS18A, LYS18B, PRO161A, PRO161B, SER183A, SER183B, THR126A, THR126B, VAL157A, VAL157B, VAL160A, VAL160B
• A-C: ALA134A, ALA134C, ARG11A, ARG129A, ARG129C, ARG156A, ARG156C, ARG180A, ARG180C, ARG184A, ASN170A, ASN170C, ASP118A, ASP118C, ASP120A, ASP120C, ASP163A, ASP163C, GLU117A, GLU122A, GLU122C, GLU125A, GLU125C, GLU173A, GLU173C, GLU176A, GLU176C, GLY158A, GLY158C, GLY159A, GLY159C, GLY169A, GLY169C, GLY172A, GLY172C, HIS127A, HIS127C, HIS128A, HIS128C, HIS153A, HIS153C, ILE123A, ILE123C, ILE152A, ILE152C, ILE171A, ILE171C, ILE175A, ILE175C, LEU155A, LEU155C, LYS178A, LYS178C, PHE130A, PHE130C, PHE168A, PHE168C, PRO151A, PRO151C, PRO161A, PRO161C, SER154A, SER154C, THR126A, THR126C, THR174A, THR174C, TRP119A, TRP119C, VAL121A, VAL121C, VAL124A, VAL124C, VAL150A, VAL157A, VAL157C, VAL160A, VAL160C, VAL165A, VAL165C, VAL166A, VAL166C, VAL167A, VAL167C
• A-D: ALA181A, ALA181D, ARG107A, ARG107D, ARG180A, ARG180D, ARG184A, ARG184D, ASN103A, ASN103D, ASN170A, ASN170D, ASN97A, ASN97D, ASP118A, ASP163A, ASP163D, GLU111A, GLU111D, GLU173A, GLU173D, GLU176A, GLU176D, GLY101A, GLY101D, GLY162A, GLY162D, GLY169A, GLY169D, GLY172A, GLY172D, GLY214A, HIS164A, HIS164D, HIS179A, HIS179D, ILE100A, ILE100D, ILE102A, ILE102D, ILE171A, ILE171D, ILE175A, ILE175D, ILE177A, ILE177D, ILE182A, ILE182D, ILE189A, ILE189D, ILE212A, LEU105A, LEU105D, LEU109A, LEU109D, LEU112A, LEU112D, LEU116A, LEU116D, LYS114D, LYS178A, LYS178D, LYS193A, PHE108A, PHE108D, PHE168A, PHE168D, PHE187A, PHE187D, PHE208A, PHE213A, PHE213D, PHE98A, PHE98D, PRO161A, PRO161D, SER110A, SER110D, SER183A, SER183D, SER99A, SER99D, THR174A, THR174D, THR185A, THR185D, TRP119A, TRP119D, VAL104A, VAL104D, VAL113A, VAL113D, VAL115A, VAL115D, VAL165A, VAL165D, VAL166A, VAL166D, VAL167A, VAL167D, VAL186A, VAL186D
• B-C: ALA181B, ALA181C, ALA188C, ARG107B, ARG107C, ARG180B, ARG180C, ARG184B, ARG184C, ASN103B, ASN103C, ASN170B, ASN170C, ASN97B, ASP118B, ASP118C, ASP163B, ASP163C, GLU111B, GLU111C, GLU117B, GLU15C, GLU173B, GLU173C, GLU176B, GLU176C, GLU196C, GLU209C, GLU22C, GLY101B, GLY101C, GLY162B, GLY162C, GLY169B, GLY169C, GLY172B, GLY172C, GLY190C, GLY214C, HIS164B, HIS164C, HIS179B, HIS179C, ILE100B, ILE100C, ILE102B, ILE102C, ILE171B, ILE171C, ILE175B, ILE175C, ILE177B, ILE177C, ILE182B, ILE182C, ILE189B, ILE189C, ILE212B, ILE212C, LEU105B, LEU105C, LEU109B, LEU109C, LEU112B, LEU112C, LEU116B, LEU116C, LYS106C, LYS114B, LYS114C, LYS178B, LYS178C, LYS18C, LYS193B, LYS193C, LYS23C, PHE108B, PHE108C, PHE168B, PHE168C, PHE187B, PHE187C, PHE208B, PHE208C, PHE213B, PHE213C, PHE98B, PHE98C, PRO161B, PRO161C, SER110C, SER183B, SER183C, SER99B, SER99C, THR174B, THR174C, THR185B, THR185C, TRP119B, TRP119C, VAL104B, VAL104C, VAL113B, VAL113C, VAL115B, VAL115C, VAL165B, VAL165C, VAL166B, VAL166C, VAL167B, VAL167C, VAL186B, VAL186C, VAL19C, VAL211C
• B-D: ALA134B, ALA134D, ARG11B, ARG11D, ARG129B, ARG129D, ARG156B, ARG156D, ARG180B, ARG180D, ARG184B, ARG184D, ASN170B, ASN170D, ASP118B, ASP118D, ASP120B, ASP120D, ASP163B, ASP163D, GLU122B, GLU122D, GLU125B, GLU125D, GLU173B, GLU173D, GLU176B, GLU176D, GLY158B, GLY158D, GLY159B, GLY159D, GLY169B, GLY169D, GLY172B, GLY172D, HIS127B, HIS127D, HIS128B, HIS128D, HIS153B, HIS153D, ILE123B, ILE123D, ILE152B, ILE152D, ILE171B, ILE171D, ILE175B, ILE175D, LEU155B, LEU155D, LYS178B, LYS178D, PHE130B, PHE130D, PHE168B, PHE168D, PRO151B, PRO151D, PRO161B, PRO161D, SER154B, SER154D, THR126B, THR126D, THR174B, THR174D, TRP119B, TRP119D, VAL121B, VAL121D, VAL124B, VAL124D, VAL157B, VAL157D, VAL160B, VAL160D, VAL165B, VAL165D, VAL166B, VAL166D, VAL167B, VAL167D
• C-D: ALA181C, ALA181D, ARG11D, ARG129D, ARG180C, ARG180D, ARG184D, ASP163C, ASP163D, GLN14C, GLN14D, GLU22C, GLY158C, GLY158D, GLY159C, GLY159D, GLY162C, GLY162D, HIS127D, HIS128C, HIS128D, HIS179C, HIS179D, ILE182C, ILE182D, ILE189C, LYS178C, LYS178D, LYS18C, LYS18D, LYS23C, PHE130D, PRO161C, PRO161D, SER183C, SER183D, THR126C, THR126D, THR185C, VAL157C, VAL157D, VAL160C, VAL160D