1NDS

crystallographic structure of a substrate bound blue copper nitrite reductase from alcaligenes xylosoxidans

• Total interactions analyzed: 3
• Total true interactions: 3
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 88
  • Norm. En. per Res.: -0.1236
• 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	0.0	17.3886	-28.2668	-10.8781	88	2	0	2266	0	0	3
A-C	0.0	18.2112	-29.4973	-11.2861	94	2	0	2388	0	0	3
B-C	0.0	17.9686	-29.9022	-11.9336	97	2	0	2337	0	0	3

Interface residues

• A-B: ALA101A, ALA102A, ALA105A, ALA120A, ALA248A, ALA271A, ALA302B, ALA335B, ALA336B, ALA340B, ARG123A, ARG128A, ARG211A, ARG250A, ARG253B, ASN249A, ASN272A, ASN277B, ASN307B, ASP329B, ASP98A, GLN113A, GLN118A, GLN275B, GLN297B, GLU119A, GLU279B, GLU310B, GLU313B, GLU82A, GLY104A, GLY107A, GLY108A, GLY117A, GLY140A, GLY258B, GLY259B, GLY285A, GLY286A, GLY299B, GLY338B, HIS100A, HIS135A, HIS255B, HIS260B, HIS306B, ILE257B, ILE309B, LEU106A, LEU111A, LEU122A, LEU213A, LEU276B, LEU308B, LEU330B, LYS125A, LYS269A, LYS296B, MET210A, MET278B, MET312B, MET331B, PHE124A, PHE132A, PHE282B, PRO143A, PRO284A, PRO337B, PRO339B, SER287A, SER333B, THR103A, THR112A, THR212A, THR214B, THR267A, THR280B, THR300B, THR332B, TRP281B, TYR301B, VAL114A, VAL115A, VAL121A, VAL133A, VAL142A, VAL146A, VAL334B
• A-C: ALA101C, ALA102C, ALA105C, ALA120C, ALA248C, ALA271C, ALA302A, ALA311A, ALA335A, ALA336A, ARG123C, ARG128C, ARG211C, ARG250C, ARG253A, ASN249C, ASN272C, ASN277A, ASN307A, ASP329A, ASP98C, GLN113C, GLN118C, GLN275A, GLN297A, GLU119C, GLU279A, GLU310A, GLU313A, GLY104C, GLY107C, GLY108C, GLY117C, GLY130C, GLY258A, GLY259A, GLY285C, GLY286C, GLY299A, GLY338A, HIS100C, HIS135C, HIS255A, HIS260A, HIS306A, ILE257A, ILE309A, LEU106C, LEU111C, LEU122C, LEU213C, LEU276A, LEU308A, LEU314A, LEU330A, LYS125C, LYS269C, LYS296A, MET210C, MET278A, MET312A, MET331A, PHE124C, PHE132C, PHE282A, PHE99C, PRO143C, PRO284C, PRO298A, PRO337A, PRO339A, SER129C, SER216A, SER287C, SER333A, THR103C, THR112C, THR212C, THR214A, THR267C, THR280A, THR300A, THR332A, TRP144C, TRP281A, TYR134C, TYR301A, VAL114C, VAL115C, VAL121C, VAL133C, VAL142C, VAL146C, VAL334A
• B-C: ALA101B, ALA102B, ALA105B, ALA120B, ALA126B, ALA248B, ALA271B, ALA335C, ALA336C, ARG123B, ARG128B, ARG211B, ARG250B, ARG253C, ASN249B, ASN272B, ASN277C, ASN307C, ASP251B, ASP328C, ASP329C, ASP98B, GLN113B, GLN118B, GLN247B, GLN275C, GLN297C, GLU119B, GLU279C, GLU310C, GLU313C, GLU82B, GLY104B, GLY107B, GLY108B, GLY117B, GLY130B, GLY258C, GLY259C, GLY268B, GLY285B, GLY286B, GLY299C, GLY338C, HIS100B, HIS135B, HIS255C, HIS260C, HIS306C, ILE257C, ILE309C, LEU106B, LEU111B, LEU122B, LEU213B, LEU276C, LEU308C, LEU314C, LEU330C, LYS125B, LYS269B, LYS296C, MET210B, MET278C, MET312C, MET331C, PHE124B, PHE132B, PHE270B, PHE282C, PHE99B, PRO143B, PRO284B, PRO298C, PRO337C, PRO339C, SER129B, SER287B, SER305C, SER333C, THR103B, THR112B, THR212B, THR214C, THR267B, THR280C, THR300C, THR332C, THR84B, TRP281C, TYR301C, VAL114B, VAL121B, VAL133B, VAL142B, VAL146B, VAL334C