3FG1

crystal structure of delta413-417:gs lox

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: A-D
  • Int. Res.: 59
  • Norm. En. per Res.: -4.5714
• 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	-35.7547	81.2001	-253.216	-207.7706	189	12	1	9956	0	106	131
A-C	0.0	0.0	-98.8659	-98.8659	48	0	3	3745	0	5	5
A-D	-15.4351	-94.6436	-159.636	-269.7147	59	13	5	6245	5	16	13
B-C	-14.7972	-89.2276	-161.514	-265.5389	59	11	5	6064	3	16	14
B-D	0.0	0.0	-104.595	-104.595	43	0	4	3743	0	2	3
C-D	-26.3047	29.3479	-254.819	-251.7758	189	7	1	10256	0	115	132

Interface residues

• A-B: ALA1015A, ALA1015B, ALA392A, ALA392B, ALA420A, ALA420B, ALA557A, ALA557B, ARG1008A, ARG1008B, ARG1029A, ARG1029B, ARG1044A, ARG1044B, ARG385A, ARG385B, ARG459A, ARG459B, ARG549A, ARG549B, ASN1012A, ASN1012B, ASN1028A, ASN1028B, ASN1045A, ASN1045B, ASN1047A, ASN1047B, ASN1062A, ASN1062B, ASN377B, ASN458A, ASN458B, ASN561A, ASN561B, ASN586A, ASN586B, ASP1006A, ASP1006B, ASP1020A, ASP1020B, ASP1025A, ASP1025B, ASP1032A, ASP1032B, ASP384A, ASP384B, ASP391A, ASP391B, ASP411A, ASP411B, ASP468A, ASP468B, ASP545B, GLN1031A, GLN1031B, GLN1043A, GLN1043B, GLN425A, GLN425B, GLU1005A, GLU1005B, GLU1007A, GLU1007B, GLU1019A, GLU1019B, GLU1035A, GLU1035B, GLU1046A, GLU1046B, GLU1058A, GLU1058B, GLU379A, GLU379B, GLU381A, GLU381B, GLU386A, GLU386B, GLU419A, GLU419B, GLU424A, GLU424B, GLU546A, GLU546B, GLU553A, GLU553B, GLY1011A, GLY1011B, GLY383A, GLY383B, GLY389A, GLY389B, GLY413A, GLY413B, GLY421A, GLY421B, GLY447A, GLY447B, GLY451A, GLY451B, GLY563A, GLY563B, ILE1027A, ILE1027B, ILE1041A, ILE1041B, ILE461A, ILE461B, ILE463A, ILE463B, ILE564A, ILE564B, ILE588A, ILE588B, LEU1010A, LEU1010B, LEU1024A, LEU1024B, LEU1034A, LEU1034B, LEU1056A, LEU1056B, LEU567A, LEU567B, LYS1002A, LYS1002B, LYS1021A, LYS1021B, LYS1033A, LYS1033B, LYS1039A, LYS1039B, LYS1040A, LYS1040B, LYS1042A, LYS1042B, LYS412A, LYS412B, LYS423A, LYS423B, LYS556A, LYS556B, PHE1030A, PHE1030B, PHE418A, PHE418B, PHE476A, PHE476B, SER1004A, SER1004B, SER1014A, SER1014B, SER1038A, SER1038B, SER414A, SER414B, SER422A, SER422B, SER450A, SER450B, SER472A, SER472B, THR1016A, THR1016B, THR382A, THR382B, THR390A, THR390B, THR393B, THR427A, THR427B, TRP1018A, TRP1018B, TRP449A, TRP449B, TRP587A, TYR1009A, TYR1009B, TYR1013A, TYR1013B, TYR426A, TYR426B, TYR448A, TYR448B, TYR998B, VAL470A, VAL470B, VAL560A, VAL560B
• A-C: ALA557A, ALA557C, ALA558A, ALA558C, ALA689A, ALA689C, ARG555A, ARG555C, ASN561A, ASN561C, ASP690A, ASP690C, GLN552A, GLN552C, GLU553A, GLU553C, GLU688A, GLY563A, GLY563C, GLY565A, GLY565C, GLY806C, GLY808A, GLY808C, ILE564A, ILE564C, LEU559A, LEU559C, LEU562A, LEU562C, LEU567A, LEU567C, LYS556A, LYS556C, LYS802C, LYS987A, MET570A, MET570C, PHE568A, PHE568C, PHE571A, PHE571C, SER566A, SER566C, SER807A, SER807C, VAL560A, VAL560C
• A-D: ARG585A, ARG585D, ASN561A, ASN561D, ASN573A, ASN573D, ASN586A, ASN586D, ASP575A, ASP575D, ASP578A, ASP578D, ASP579A, ASP579D, GLU572A, GLU572D, GLY563A, GLY563D, GLY565A, GLY565D, HIS581A, HIS581D, ILE564A, ILE564D, ILE582A, ILE582D, ILE588A, ILE588D, LEU562A, LEU562D, LEU567A, LEU567D, LEU583A, LEU583D, LYS987A, LYS987D, MET570A, MET570D, PHE568A, PHE568D, PHE571A, PHE571D, SER566A, SER566D, SER576A, SER576D, THR569A, THR569D, TRP574A, TRP574D, TRP587A, TRP587D, TYR577A, TYR580A, TYR580D, TYR584A, TYR584D, VAL560A, VAL560D
• B-C: ARG585B, ARG585C, ASN561B, ASN561C, ASN573B, ASN573C, ASN586B, ASN586C, ASP575B, ASP575C, ASP578B, ASP578C, ASP579B, ASP579C, GLU572B, GLU572C, GLY563B, GLY563C, GLY565B, GLY565C, HIS581B, HIS581C, ILE564B, ILE564C, ILE582B, ILE582C, ILE588B, ILE588C, LEU562B, LEU562C, LEU567B, LEU567C, LEU583B, LEU583C, LYS987B, LYS987C, MET570B, MET570C, PHE568B, PHE568C, PHE571B, PHE571C, SER566B, SER566C, SER576B, SER576C, THR569B, THR569C, THR592C, TRP574B, TRP574C, TRP587B, TRP587C, TYR580B, TYR580C, TYR584B, TYR584C, VAL560B, VAL560C
• B-D: ALA557B, ALA557D, ALA558B, ALA558D, ALA689B, ALA689D, ARG555B, ARG555D, ASN561B, ASN561D, GLN552B, GLN552D, GLU553B, GLU553D, GLY563B, GLY563D, GLY565B, GLY565D, GLY808B, GLY808D, ILE564B, ILE564D, LEU559B, LEU559D, LEU562B, LEU562D, LEU567B, LEU567D, LYS556B, LYS556D, LYS987B, MET570B, MET570D, PHE568B, PHE568D, PHE571B, PHE571D, SER566B, SER566D, SER807B, SER807D, VAL560B, VAL560D
• C-D: ALA1015C, ALA1015D, ALA392C, ALA392D, ALA420C, ALA420D, ALA557C, ALA557D, ARG1008C, ARG1008D, ARG1029C, ARG1029D, ARG1044C, ARG1044D, ARG385C, ARG385D, ARG459C, ARG459D, ARG549C, ARG549D, ASN1012C, ASN1012D, ASN1028C, ASN1028D, ASN1045C, ASN1045D, ASN1047C, ASN1047D, ASN1062C, ASN1062D, ASN377D, ASN458C, ASN458D, ASN561C, ASN561D, ASN586C, ASP1006C, ASP1006D, ASP1020D, ASP1025C, ASP1025D, ASP1032C, ASP1032D, ASP384C, ASP384D, ASP391C, ASP391D, ASP411C, ASP411D, ASP545C, ASP545D, GLN1031C, GLN1031D, GLN1043C, GLN1043D, GLN425C, GLN425D, GLU1005C, GLU1005D, GLU1007C, GLU1007D, GLU1019C, GLU1019D, GLU1035C, GLU1035D, GLU1046C, GLU1046D, GLU1058C, GLU1058D, GLU379C, GLU379D, GLU381C, GLU381D, GLU386C, GLU386D, GLU419C, GLU419D, GLU424C, GLU424D, GLU546C, GLU546D, GLU553C, GLU553D, GLY1011C, GLY1011D, GLY383C, GLY383D, GLY389C, GLY389D, GLY413C, GLY413D, GLY421C, GLY421D, GLY447C, GLY447D, GLY451C, GLY451D, GLY563C, GLY563D, HIS387C, HIS387D, ILE1027C, ILE1027D, ILE1041C, ILE1041D, ILE461C, ILE461D, ILE463C, ILE463D, ILE564C, ILE564D, ILE588C, ILE588D, LEU1010C, LEU1010D, LEU1024C, LEU1024D, LEU1034C, LEU1034D, LEU1056C, LEU1056D, LEU567C, LEU567D, LYS1002C, LYS1002D, LYS1021C, LYS1021D, LYS1033C, LYS1033D, LYS1039C, LYS1039D, LYS1040C, LYS1040D, LYS1042C, LYS1042D, LYS412C, LYS412D, LYS423C, LYS423D, LYS556C, LYS556D, PHE1030C, PHE1030D, PHE418C, PHE418D, PHE476C, PHE476D, SER1004C, SER1004D, SER1014C, SER1014D, SER1038C, SER1038D, SER414C, SER414D, SER422C, SER422D, SER450C, SER450D, SER472C, THR1016C, THR1016D, THR382C, THR382D, THR390C, THR390D, THR393C, THR393D, THR427C, THR427D, TRP1018C, TRP449C, TRP449D, TRP587C, TRP587D, TYR1009C, TYR1009D, TYR1013C, TYR1013D, TYR426C, TYR426D, TYR448C, TYR448D, TYR998C, TYR998D, VAL470C, VAL470D, VAL560C, VAL560D