3O5A

crystal structure of partially reduced periplasmic nitrate reductase from cupriavidus necator using ionic liquids

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 247
  • Norm. En. per Res.: -4.0835
• 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	-154.7378	-25.8224	-828.056	-1008.6161	247	36	21	33348	5	63	76

Interface residues

• A-B: ALA106B, ALA11B, ALA13B, ALA18B, ALA190A, ALA226A, ALA31A, ALA39A, ALA46A, ALA490A, ALA492A, ALA493A, ALA5B, ALA718A, ALA771A, ALA89A, ARG17B, ARG199A, ARG203A, ARG204A, ARG211A, ARG221A, ARG473A, ARG515A, ARG631A, ARG69A, ARG706A, ARG707A, ARG713A, ARG72A, ARG733A, ARG734A, ARG746A, ARG748A, ARG750A, ARG754A, ARG756A, ARG76A, ARG7B, ARG83B, ARG94B, ARG95B, ASN114B, ASN115B, ASN14B, ASN26B, ASN35A, ASN456A, ASN49A, ASN53A, ASN56B, ASN717A, ASN85B, ASP107B, ASP118B, ASP120B, ASP174A, ASP202A, ASP224A, ASP227A, ASP34A, ASP47B, ASP483A, ASP4B, ASP52B, ASP54B, ASP68A, ASP770A, ASP82B, ASP84B, ASP87A, CYS101B, CYS222A, CYS54A, CYS98B, GLN100B, GLN105B, GLN38B, GLN41A, GLN459A, GLN45A, GLN50B, GLN67A, GLN773A, GLU15B, GLU177A, GLU191A, GLU25B, GLU47A, GLU697A, GLU710A, GLU737A, GLU739A, GLU752A, GLY113B, GLY1B, GLY42A, GLY468A, GLY48B, GLY51A, GLY57A, GLY66A, GLY702A, GLY735A, GLY745A, GLY755A, GLY86A, GLY8B, HIS102B, HIS193A, HIS207A, HIS698A, HIS79B, ILE112B, ILE122B, ILE12B, ILE195A, ILE228A, ILE42B, ILE46B, ILE63A, ILE751A, ILE775A, LEU111B, LEU123B, LEU12A, LEU196A, LEU205A, LEU20B, LEU21B, LEU225A, LEU2B, LEU464A, LEU469A, LEU491A, LEU495A, LEU51B, LEU52A, LEU60A, LEU696A, LEU70A, LEU711A, LEU74A, LEU774A, LEU88B, LYS109B, LYS11A, LYS27B, LYS33A, LYS36A, LYS50A, LYS53B, LYS56A, LYS62A, LYS777A, MET189A, MET37B, MET458A, MET465A, MET64A, MET6B, MET704A, MET747A, MET75A, MET81B, PHE116B, PHE176A, PHE223A, PHE55B, PHE59A, PHE715A, PHE769A, PHE88A, PHE97B, PRO104B, PRO110B, PRO16B, PRO194A, PRO19B, PRO23B, PRO39B, PRO40B, PRO43B, PRO44A, PRO470A, PRO486A, PRO709A, PRO716A, PRO90A, PRO93B, PRO9B, SER206A, SER61A, SER701A, SER703A, SER714A, SER749A, SER772A, SER92B, THR108B, THR10B, THR121B, THR198A, THR201A, THR210A, THR24B, THR40A, THR41B, THR487A, THR489A, THR705A, THR753A, THR78B, THR99B, TRP14A, TRP197A, TYR173A, TYR22B, TYR472A, TYR485A, TYR58A, TYR65A, TYR712A, TYR96B, VAL103B, VAL117B, VAL119B, VAL200A, VAL212A, VAL32A, VAL37A, VAL38A, VAL3B, VAL481A, VAL488A, VAL48A, VAL496A, VAL55A, VAL708A, VAL719A, VAL720A, VAL736A, VAL738A, VAL740A, VAL741A, VAL802A, VAL91B