3E59

crystal structure of the pvca (pa2254) protein from pseudomonas aeruginosa

• Total interactions analyzed: 6
• Total true interactions: 3
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 65
  • Norm. En. per Res.: -2.9801
• 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	-23.3937	25.1706	-241.559	-239.782	120	13	2	10548	3	36	48
A-C	-12.4913	-50.1688	-131.047	-193.7072	65	1	3	5571	3	25	28
C-D	-35.226	24.8504	-249.7	-260.0756	121	16	2	10677	7	34	49

Interface residues

• A-B: ALA103A, ALA103B, ALA106B, ALA144A, ALA144B, ALA283A, ALA283B, ARG12A, ARG12B, ARG21A, ARG272B, ARG289A, ARG289B, ARG316B, ARG85A, ARG85B, ARG97A, ARG97B, ASN285A, ASN285B, ASN309A, ASN309B, ASN92A, ASN92B, ASP288A, ASP288B, CYS95B, GLN307A, GLN307B, GLN96A, GLN96B, GLN99A, GLN99B, GLU140A, GLU140B, GLU141A, GLU141B, GLU16A, GLU16B, GLU287A, GLU287B, GLY105B, GLY143A, GLY143B, HIS146A, HIS146B, HIS267A, HIS267B, HIS314A, HIS314B, HIS93A, HIS93B, ILE139A, ILE139B, ILE142A, ILE142B, ILE147A, ILE147B, ILE308A, ILE308B, ILE98A, ILE98B, LEU100A, LEU100B, LEU137A, LEU137B, LEU17A, LEU17B, LEU18A, LEU18B, LEU19A, LEU19B, LEU86A, LEU86B, LEU88A, LEU91A, LEU91B, LEU94A, LEU94B, LYS107A, LYS107B, LYS15A, LYS15B, MET138A, MET138B, MET268A, MET269A, MET269B, MET82A, MET82B, PHE101A, PHE101B, PHE290A, PHE290B, PHE90A, PHE90B, PRO104B, PRO270A, PRO270B, PRO57B, SER313A, SER313B, SER87A, SER89A, SER89B, THR145A, THR145B, THR271B, THR286A, THR286B, TYR102A, TYR102B, TYR20A, TYR20B, VAL284A, VAL284B, VAL291A, VAL291B, VAL306A, VAL306B
• A-C: ALA157A, ALA160A, ALA177A, ALA189C, ALA219C, ALA228C, ALA237A, ALA240A, ALA243A, ALA249A, ARG156A, ARG184C, ARG198C, ARG222C, ARG248A, ARG47A, ASP223C, ASP244A, ASP260A, GLN161A, GLN221C, GLN245A, GLN42A, GLU159A, GLU178A, GLU185C, GLU191C, GLU192C, GLU226C, GLU59A, GLY174A, GLY175A, GLY193C, GLY239A, ILE173A, LEU171A, LEU172A, LEU187C, LEU188C, LEU194C, LEU195C, LEU241A, LEU242A, LEU262A, LYS217C, LYS225C, PHE150A, PHE158A, PHE246A, PHE51A, PRO247A, PRO46A, SER182C, SER190C, SER216C, SER261A, THR186C, THR201C, THR218C, TRP236A, TYR176A, TYR197C, TYR229C, VAL155A, VAL43A
• C-D: ALA103C, ALA103D, ALA106C, ALA106D, ALA144C, ALA144D, ALA283C, ALA283D, ARG12C, ARG12D, ARG21D, ARG272C, ARG289C, ARG289D, ARG316C, ARG85C, ARG85D, ARG97C, ARG97D, ASN285C, ASN285D, ASN309C, ASN309D, ASN92C, ASN92D, ASP288C, ASP288D, GLN307C, GLN307D, GLN311C, GLN96C, GLN96D, GLN99C, GLN99D, GLU140C, GLU140D, GLU141C, GLU141D, GLU16C, GLU16D, GLU287C, GLU287D, GLY105C, GLY143C, GLY143D, GLY310D, HIS146C, HIS146D, HIS267C, HIS267D, HIS314C, HIS314D, HIS93C, HIS93D, ILE139C, ILE139D, ILE142C, ILE142D, ILE147C, ILE147D, ILE308C, ILE308D, ILE98C, ILE98D, LEU100C, LEU100D, LEU137C, LEU137D, LEU17C, LEU17D, LEU18C, LEU18D, LEU19C, LEU19D, LEU86C, LEU86D, LEU88D, LEU91C, LEU91D, LEU94C, LEU94D, LYS107C, LYS107D, LYS15C, LYS15D, MET138C, MET138D, MET268D, MET269C, MET269D, MET82C, MET82D, PHE101C, PHE101D, PHE290C, PHE290D, PHE90C, PHE90D, PRO104C, PRO270C, PRO270D, PRO57C, SER313C, SER313D, SER87D, SER89C, SER89D, THR145C, THR145D, THR271C, THR286C, THR286D, TYR102D, TYR20C, TYR20D, VAL284C, VAL284D, VAL291C, VAL291D, VAL306C, VAL306D