3P7X

crystal structure of an atypical two-cysteine peroxiredoxin (saouhsc_01822) from staphylococcus aureus nctc8325

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 78
  • Norm. En. per Res.: -2.911
• 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	0.0	3.8482	-86.2057	-82.3575	43	0	2	3266	0	16	12
A-C	-14.4643	-14.4973	-198.095	-227.0566	78	4	6	8444	2	43	30
A-D	0.0	0.0	-0.0047	-0.0047	3	0	0	7	0	1	1
B-D	-15.2842	-18.9167	-189.641	-223.8419	84	12	6	8505	2	44	28
C-D	0.0	0.0	-0.0004	-0.0004	2	0	0	1	0	3	2

Interface residues

• A-B: ALA135A, ALA24A, ALA40A, ALA43A, ALA94B, ALA96B, ARG65B, ARG91B, ASN100B, ASN137A, ASN68B, ASP134A, ASP136A, ASP22A, ASP26A, ASP41A, ASP61B, ASP70B, ASP99B, CYS93B, GLN36A, GLN62B, GLN63B, GLY44A, GLY97B, LEU133A, LEU39A, LEU98B, LYS138A, LYS45A, LYS47A, LYS66B, LYS73B, PHE23A, PHE27A, PRO25A, SER69B, SER95B, THR38A, TRP92B, TYR42A, VAL101B, VAL139A
• A-C: ALA83A, ALA83C, ALA88A, ALA88C, ARG108A, ARG108C, ARG124A, ARG124C, ARG91A, ARG91C, ASP106A, ASP106C, ASP109A, ASP109C, ASP33A, ASP33C, ASP56A, ASP56C, ASP84A, ASP84C, CYS60A, CYS60C, GLN89A, GLN89C, GLU121A, GLU121C, GLU122A, GLU122C, GLY58A, GLY58C, HIS107A, HIS107C, ILE11A, ILE11C, ILE55A, ILE55C, LEU110A, LEU110C, LEU123A, LEU123C, LEU125A, LEU125C, LEU126A, LEU126C, LEU30A, LEU30C, LEU34A, LEU34C, LEU85A, LEU85C, LYS7A, LYS7C, LYS90A, LYS90C, MET120A, MET120C, PHE6A, PHE6C, PHE87A, PHE87C, PRO53A, PRO53C, PRO86A, PRO86C, SER105A, SER105C, SER54A, SER54C, SER82A, SER82C, SER95A, SER95C, THR57A, THR57C, TRP92A, TRP92C, VAL52A, VAL52C
• A-D: ASN115A, ASP26A, SER95D
• B-D: ALA83B, ALA83D, ALA88B, ALA88D, ALA94D, ARG108B, ARG108D, ARG124B, ARG124D, ARG91B, ARG91D, ASP106B, ASP106D, ASP109B, ASP109D, ASP33B, ASP33D, ASP56B, ASP56D, ASP61B, ASP84B, ASP84D, CYS60B, CYS60D, CYS93D, GLN36B, GLN36D, GLN89B, GLN89D, GLU121B, GLU121D, GLU122B, GLU122D, GLY58B, GLY58D, HIS107B, HIS107D, ILE11B, ILE11D, ILE55B, ILE55D, LEU110B, LEU110D, LEU123B, LEU123D, LEU125B, LEU125D, LEU126B, LEU126D, LEU30B, LEU30D, LEU34B, LEU34D, LEU85B, LEU85D, LYS14D, LYS7B, LYS7D, LYS90B, LYS90D, MET120B, MET120D, PHE6B, PHE6D, PHE87B, PHE87D, PRO53B, PRO53D, PRO86B, PRO86D, SER105B, SER105D, SER54B, SER54D, SER82B, SER82D, SER95B, SER95D, THR57B, THR57D, TRP92B, TRP92D, VAL52B, VAL52D
• C-D: HIS12C, LYS66D