3M0Z

crystal structure of putative aldolase from klebsiella pneumoniae.

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 99
  • Norm. En. per Res.: -3.3483
• 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	-68.5449	0.0	-262.937	-331.4819	99	9	9	10119	0	6	9
A-C	0.0	0.0	-23.1261	-23.1261	34	3	0	1129	0	4	5
A-D	-21.7831	21.7602	-96.676	-96.6988	55	4	0	4146	0	25	23
B-C	-22.9589	-26.5992	-73.5098	-123.0679	50	1	0	3324	3	24	23
C-D	-60.1496	0.0	-259.051	-319.2006	99	8	8	9902	0	6	10

Interface residues

• A-B: ALA100A, ALA100B, ALA104A, ALA104B, ALA137A, ALA137B, ALA138A, ALA138B, ALA147A, ALA147B, ALA149A, ALA149B, ALA78A, ALA78B, ARG103A, ARG103B, ARG85A, ARG85B, ASN75A, ASN75B, ASP139A, ASP139B, ASP153A, ASP153B, ASP184B, GLU145A, GLU145B, GLY107A, GLY107B, GLY131A, GLY131B, GLY136A, GLY136B, GLY140A, GLY140B, GLY155A, GLY155B, GLY98A, GLY98B, HIS183A, HIS183B, ILE128A, ILE128B, ILE141A, ILE141B, ILE148A, ILE148B, LEU105A, LEU105B, LEU106A, LEU106B, LEU133A, LEU133B, LEU144A, LEU144B, LEU150A, LEU150B, LEU151A, LEU151B, LYS127A, LYS127B, LYS152A, LYS152B, PHE96A, PHE96B, PRO132A, PRO132B, PRO143A, PRO143B, PRO74A, PRO74B, SER102A, SER102B, SER129A, SER129B, SER134A, SER134B, SER135A, SER135B, SER77A, SER77B, SER81A, SER81B, THR101A, THR101B, THR130A, THR130B, THR146A, THR146B, THR97A, THR97B, VAL126A, VAL126B, VAL142A, VAL142B, VAL95A, VAL95B, VAL99A, VAL99B
• A-C: ALA0A, ALA0C, ALA48A, ALA48C, ARG55A, ARG55C, ARG85A, ARG85C, ASN-1A, ASN-1C, ASN109A, ASN109C, GLN108A, GLN108C, GLN86A, GLN86C, GLN88A, GLN88C, GLU82A, GLU82C, GLY107A, GLY107C, LEU105A, LEU105C, LYS59A, LYS59C, VAL47A, VAL47C, VAL51A, VAL51C, VAL52A, VAL52C, VAL87A, VAL87C
• A-D: ALA0A, ALA0D, ALA104D, ALA48D, ALA58A, ALA58D, ALA64A, ALA78D, ARG103D, ARG25A, ARG55A, ARG55D, ARG85D, ASN-1A, ASN-1D, ASN23A, ASN63A, ASN63D, ASP22A, ASP29A, ASP56A, ASP56D, ASP62A, ASP62D, GLN108D, GLN86D, GLN88D, GLN90A, GLU26A, GLU82D, GLY107D, ILE61A, ILE83D, LEU105D, LEU106D, LEU3D, LEU60A, LEU60D, LYS21A, LYS2A, LYS2D, LYS59A, LYS59D, PRO89D, SER-2D, SER102D, SER20A, SER84D, TYR28A, TYR57A, VAL47D, VAL51D, VAL52A, VAL52D, VAL87D
• B-C: ALA0B, ALA0C, ALA104B, ALA48B, ALA58B, ALA58C, ALA64C, ALA78B, ARG103B, ARG235C, ARG25C, ARG55B, ARG55C, ARG85B, ASN-1C, ASN63B, ASN63C, ASP22C, ASP29C, ASP56B, ASP56C, ASP62B, ASP62C, GLN108B, GLN86B, GLN88B, GLN90C, GLU26C, GLU82B, GLY107B, ILE61C, LEU105B, LEU106B, LEU3B, LEU60C, LYS21C, LYS2B, LYS2C, LYS59B, LYS59C, PRO89B, SER102B, SER84B, TYR28C, TYR57C, VAL47B, VAL51B, VAL52B, VAL52C, VAL87B
• C-D: ALA100C, ALA100D, ALA104C, ALA104D, ALA137C, ALA137D, ALA138C, ALA138D, ALA147C, ALA147D, ALA149C, ALA149D, ALA78C, ALA78D, ARG103C, ARG103D, ARG85C, ARG85D, ASN75D, ASP139C, ASP139D, ASP153C, ASP153D, ASP184C, GLU145C, GLU145D, GLY107C, GLY107D, GLY131C, GLY131D, GLY136C, GLY136D, GLY140C, GLY140D, GLY155C, GLY155D, GLY98C, GLY98D, HIS183C, HIS183D, ILE128C, ILE128D, ILE141C, ILE141D, ILE148C, ILE148D, LEU105C, LEU105D, LEU106C, LEU106D, LEU133C, LEU133D, LEU144C, LEU144D, LEU150C, LEU150D, LEU151C, LEU151D, LYS127C, LYS127D, LYS152C, LYS152D, PHE185C, PHE96C, PHE96D, PRO132C, PRO132D, PRO143C, PRO143D, PRO74C, PRO74D, SER102C, SER102D, SER129C, SER129D, SER134C, SER134D, SER135C, SER135D, SER77C, SER77D, SER81C, SER81D, THR101C, THR101D, THR130C, THR130D, THR146C, THR146D, THR97C, THR97D, VAL126C, VAL126D, VAL142C, VAL142D, VAL95C, VAL95D, VAL99C, VAL99D