4NOS

human inducible nitric oxide synthase with inhibitor

• Total interactions analyzed: 6
• Total true interactions: 3
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 234
  • Norm. En. per Res.: -4.3125
• Hub Node: A(2)

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	-154.4538	-54.6412	-754.664	-963.7589	232	42	16	30989	11	51	69
A-C	0.0	-9.6962	-56.7225	-66.4187	32	5	1	2532	1	14	10
C-D	-186.0793	-46.7604	-776.292	-1009.1317	234	48	16	31035	10	48	66

Interface residues

• A-B: ALA104A, ALA104B, ALA407A, ALA407B, ALA414A, ALA414B, ALA421A, ALA421B, ALA439A, ALA439B, ALA440A, ALA440B, ALA459A, ALA459B, ARG111A, ARG111B, ARG199B, ARG381A, ARG381B, ARG388A, ARG388B, ARG83A, ARG83B, ARG86A, ARG86B, ASN390B, ASN419A, ASN419B, ASN482A, ASN482B, ASN89A, ASN89B, ASP382B, ASP385A, ASP385B, ASP412A, ASP412B, ASP435A, ASP435B, ASP460A, ASP460B, ASP98A, ASP98B, CYS110A, CYS110B, CYS115A, CYS115B, CYS384A, CYS384B, GLN387A, GLN387B, GLN413A, GLN413B, GLN427A, GLN427B, GLN478A, GLN478B, GLU377B, GLU402A, GLU402B, GLU417A, GLU417B, GLU441A, GLU441B, GLU479A, GLU479B, GLY106A, GLY106B, GLY117A, GLY117B, GLY375A, GLY375B, GLY379A, GLY379B, GLY470A, GLY470B, GLY91A, GLY91B, GLY93A, GLY93B, HIS101A, HIS101B, HIS102A, HIS102B, HIS333A, HIS333B, HIS424A, HIS424B, HIS436A, HIS436B, HIS437A, HIS437B, HIS477A, HIS477B, HIS84A, ILE107A, ILE107B, ILE119A, ILE119B, ILE418A, ILE418B, ILE420A, ILE420B, ILE423A, ILE423B, ILE433A, ILE433B, ILE462A, ILE462B, ILE472A, ILE472B, ILE87A, ILE87B, LEU100A, LEU100B, LEU108A, LEU108B, LEU116A, LEU116B, LEU392A, LEU392B, LEU401A, LEU401B, LEU406A, LEU406B, LEU409A, LEU409B, LEU464A, LEU481A, LEU481B, LEU485A, LEU485B, LYS103A, LYS103B, LYS105A, LYS105B, LYS113A, LYS113B, LYS335A, LYS335B, LYS405A, LYS405B, LYS411A, LYS411B, LYS88A, LYS88B, MET120A, MET120B, MET399A, MET399B, MET434A, MET434B, MET447A, MET468A, MET468B, MET480A, MET480B, PHE383B, PHE476A, PHE476B, PRO122A, PRO122B, PRO334A, PRO334B, PRO458A, PRO458B, PRO466A, PRO466B, PRO467A, PRO467B, PRO474A, PRO474B, SER112A, SER112B, SER114A, SER114B, SER118A, SER118B, SER124A, SER124B, SER408A, SER408B, SER438A, SER438B, SER442A, SER469A, SER469B, SER471A, SER471B, SER92A, SER92B, THR109A, THR109B, THR121A, THR121B, THR376A, THR376B, THR473A, THR473B, THR99A, THR99B, TRP410A, TRP410B, TRP461A, TRP461B, TRP463A, TRP463B, TRP90A, TRP90B, TYR336A, TYR336B, TYR451B, TYR483A, TYR483B, VAL380A, VAL380B, VAL386A, VAL386B, VAL415A, VAL415B, VAL416A, VAL416B, VAL422A, VAL422B, VAL465A, VAL465B, VAL475A, VAL475B, VAL484A, VAL484B, VAL85A, VAL85B
• A-C: ALA157A, ALA164A, ARG278C, ASN148A, ASP274C, GLN149A, GLN271C, GLN288C, GLU145A, GLU160A, GLU161A, GLU167A, GLY152A, GLY275C, GLY300C, HIS162A, ILE144A, ILE159A, ILE291C, LEU163A, LYS158A, LYS296C, LYS298C, MET272C, PRO273C, PRO297C, SER276C, TYR151A, TYR270C, TYR299C, VAL147A, VAL166A
• C-D: ALA104C, ALA104D, ALA407C, ALA407D, ALA414C, ALA414D, ALA421C, ALA421D, ALA439C, ALA439D, ALA440C, ALA440D, ALA459C, ALA459D, ARG111C, ARG111D, ARG199C, ARG199D, ARG381C, ARG381D, ARG388C, ARG388D, ARG83C, ARG83D, ARG86C, ARG86D, ASN419C, ASN419D, ASN482C, ASN482D, ASN89C, ASN89D, ASP382D, ASP385C, ASP385D, ASP412C, ASP412D, ASP435C, ASP435D, ASP460C, ASP460D, ASP98C, ASP98D, CYS110C, CYS110D, CYS115C, CYS115D, CYS384C, CYS384D, GLN387C, GLN387D, GLN413C, GLN413D, GLN427C, GLN427D, GLN478C, GLN478D, GLU377D, GLU402D, GLU417C, GLU417D, GLU441C, GLU441D, GLU479C, GLU479D, GLY106C, GLY106D, GLY117C, GLY117D, GLY375C, GLY375D, GLY379C, GLY379D, GLY470C, GLY470D, GLY91C, GLY91D, GLY93C, GLY93D, HIS101C, HIS101D, HIS102C, HIS102D, HIS333C, HIS333D, HIS424C, HIS424D, HIS436C, HIS436D, HIS437C, HIS437D, HIS477C, HIS477D, HIS84C, HIS84D, ILE107C, ILE107D, ILE119C, ILE119D, ILE418C, ILE418D, ILE420C, ILE420D, ILE423C, ILE423D, ILE433C, ILE433D, ILE462C, ILE462D, ILE472C, ILE472D, ILE87C, ILE87D, LEU100C, LEU100D, LEU108C, LEU108D, LEU116C, LEU116D, LEU392C, LEU392D, LEU401C, LEU401D, LEU406C, LEU406D, LEU409C, LEU409D, LEU464D, LEU481C, LEU481D, LEU485C, LEU485D, LYS103C, LYS103D, LYS105C, LYS105D, LYS113C, LYS113D, LYS335C, LYS335D, LYS405C, LYS405D, LYS411C, LYS411D, LYS88C, LYS88D, MET120C, MET120D, MET399C, MET399D, MET434C, MET434D, MET447C, MET447D, MET468C, MET468D, MET480C, MET480D, MET94D, PHE383D, PHE476C, PHE476D, PRO122C, PRO122D, PRO334C, PRO334D, PRO458C, PRO458D, PRO466C, PRO466D, PRO467C, PRO467D, PRO474C, PRO474D, SER112C, SER112D, SER114C, SER114D, SER118C, SER118D, SER124C, SER124D, SER408C, SER408D, SER438C, SER438D, SER442C, SER442D, SER469C, SER469D, SER471C, SER471D, SER92C, SER92D, THR109C, THR109D, THR121C, THR121D, THR376C, THR376D, THR473C, THR473D, THR99C, THR99D, TRP410C, TRP410D, TRP461C, TRP461D, TRP463C, TRP463D, TRP90C, TRP90D, TYR336C, TYR336D, TYR483C, TYR483D, VAL380C, VAL380D, VAL386C, VAL386D, VAL415C, VAL415D, VAL416C, VAL416D, VAL422C, VAL422D, VAL465C, VAL465D, VAL475C, VAL475D, VAL484C, VAL484D, VAL85C, VAL85D