1XCP

crystal structure of the nitrogenase fe protein phe135trp with mgadp bound

• Total interactions analyzed: 6
• Total true interactions: 2
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 186
  • Norm. En. per Res.: -2.9052
• 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	-60.2902	-76.1936	-401.721	-538.2048	189	23	6	17084	4	93	46
C-D	-58.5406	-83.5893	-398.24	-540.3699	186	11	6	17236	1	96	45

Interface residues

• A-B: ALA136A, ALA136B, ALA220A, ALA220B, ALA234A, ALA234B, ALA286A, ALA286B, ALA42A, ALA42B, ALA53A, ALA53B, ALA98A, ALA98B, ARG100A, ARG100B, ARG140A, ARG140B, ARG187A, ARG187B, ARG219A, ARG219B, ARG223A, ARG223B, ARG224A, ARG224B, ARG46A, ARG46B, ASN162A, ASN162B, ASN163A, ASN163B, ASP129A, ASP129B, ASP231A, ASP231B, ASP262A, ASP262B, ASP278A, ASP278B, ASP39A, ASP39B, ASP43A, ASP43B, CYS132A, CYS132B, CYS38A, CYS38B, CYS97A, CYS97B, GLN218A, GLN218B, GLU154A, GLU154B, GLU221A, GLU221B, GLU229A, GLU229B, GLU265A, GLU265B, GLU275A, GLU275B, GLU277A, GLU277B, GLU279A, GLU279B, GLU287A, GLU287B, GLU288A, GLU288B, GLU92A, GLU92B, GLY11A, GLY11B, GLY12A, GLY12B, GLY133A, GLY133B, GLY134A, GLY134B, GLY167A, GLY167B, GLY283A, GLY283B, GLY90A, GLY90B, GLY94A, GLY94B, GLY96A, GLY96B, GLY99A, GLY99B, HIS50A, HIS50B, ILE139A, ILE139B, ILE164A, ILE164B, ILE168A, ILE168B, ILE222A, ILE222B, ILE228A, ILE228B, ILE281A, ILE281B, LEU127A, LEU127B, LEU264A, LEU264B, LEU47A, LEU47B, LEU49A, LEU49B, LYS10A, LYS10B, LYS15A, LYS15B, LYS166A, LYS166B, LYS170A, LYS170B, LYS233A, LYS233B, LYS284A, LYS284B, LYS41A, LYS41B, LYS52A, LYS52B, MET137A, MET137B, MET155A, MET155B, MET156A, MET156B, MET225A, MET225B, MET261A, MET261B, MET269A, MET269B, MET274A, MET274B, PRO232A, PRO232B, PRO258B, PRO40A, PRO40B, PRO91A, PRO91B, PRO93A, PRO93B, SER280A, SER280B, SER51A, SER51B, THR226A, THR226B, THR285A, THR285B, TRP135A, TRP135B, TYR159A, TYR159B, TYR171A, TYR171B, TYR230A, TYR230B, TYR80A, TYR80B, VAL130A, VAL130B, VAL131A, VAL131B, VAL169A, VAL169B, VAL216A, VAL216B, VAL227A, VAL227B, VAL276A, VAL276B, VAL282A, VAL282B, VAL289A, VAL289B, VAL95A, VAL95B
• C-D: ALA136C, ALA136D, ALA220C, ALA220D, ALA234C, ALA234D, ALA286C, ALA286D, ALA42C, ALA42D, ALA53C, ALA53D, ALA98C, ALA98D, ARG100C, ARG100D, ARG140C, ARG140D, ARG219C, ARG219D, ARG223C, ARG223D, ARG224C, ARG224D, ARG46C, ARG46D, ASN162C, ASN162D, ASN163C, ASN163D, ASP129C, ASP129D, ASP231C, ASP231D, ASP262C, ASP262D, ASP278C, ASP278D, ASP39C, ASP39D, ASP43C, ASP43D, CYS132C, CYS132D, CYS38C, CYS38D, CYS97C, CYS97D, GLN218C, GLN218D, GLU221C, GLU221D, GLU229C, GLU229D, GLU265C, GLU265D, GLU275C, GLU275D, GLU277C, GLU277D, GLU279C, GLU279D, GLU287C, GLU287D, GLU288C, GLU288D, GLU92C, GLU92D, GLY11C, GLY11D, GLY12C, GLY12D, GLY133C, GLY133D, GLY134C, GLY134D, GLY167C, GLY167D, GLY283C, GLY283D, GLY90C, GLY90D, GLY94C, GLY94D, GLY96C, GLY96D, GLY99C, GLY99D, HIS50C, HIS50D, ILE139C, ILE139D, ILE164C, ILE164D, ILE168C, ILE168D, ILE222C, ILE222D, ILE228C, ILE228D, ILE281C, ILE281D, LEU127C, LEU127D, LEU47C, LEU47D, LEU49C, LEU49D, LYS10C, LYS10D, LYS15C, LYS15D, LYS166C, LYS166D, LYS170C, LYS170D, LYS233C, LYS233D, LYS284C, LYS284D, LYS41C, LYS41D, LYS52C, LYS52D, MET137C, MET137D, MET155C, MET155D, MET156C, MET156D, MET225C, MET225D, MET261C, MET261D, MET269C, MET269D, MET274C, MET274D, PRO232C, PRO232D, PRO258C, PRO258D, PRO40C, PRO40D, PRO91C, PRO91D, PRO93C, PRO93D, SER165C, SER165D, SER280C, SER280D, SER51C, SER51D, THR226C, THR226D, THR285C, THR285D, TRP135C, TRP135D, TYR159C, TYR159D, TYR171C, TYR171D, TYR230C, TYR230D, TYR80C, TYR80D, VAL130C, VAL130D, VAL131C, VAL131D, VAL169C, VAL169D, VAL216C, VAL216D, VAL227C, VAL227D, VAL276C, VAL276D, VAL282C, VAL282D, VAL289C, VAL289D, VAL95C, VAL95D