2NZO

crystal structure of a secretion chaperone csaa from bacillus subtilis in the space group p 32 2 1

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 114
  • Norm. En. per Res.: -6.1042
• 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	-161.0188	-42.4563	-492.399	-695.8741	114	23	22	18907	2	31	19
A-C	-15.33	1.2818	-92.0589	-106.1071	43	4	0	3534	0	14	15
A-D	-10.9694	-2.194	-34.8584	-48.0218	35	1	0	1861	0	6	3
B-C	-9.4779	0.0	-25.8176	-35.2955	34	0	0	1596	0	6	3
B-D	-17.1946	-1.5674	-86.3224	-105.0845	42	3	0	3588	0	16	15
C-D	-159.4122	-37.7276	-460.811	-657.9508	111	25	19	18468	2	24	17

Interface residues

• A-B: ALA2A, ALA2B, ALA66A, ALA66B, ARG13A, ARG13B, ARG53A, ARG53B, ARG73A, ARG73B, ASN69A, ASN69B, ASP100A, ASP100B, ASP11A, ASP11B, ASP5A, ASP5B, ASP6A, ASP6B, ASP93A, ASP93B, GLN101A, GLN101B, GLN63A, GLN63B, GLN98A, GLN98B, GLU8A, GLU8B, GLY106A, GLY106B, GLY110A, GLY110B, GLY58A, GLY86A, GLY86B, GLY87A, GLY87B, GLY90A, GLY90B, HIS0A, HIS0B, ILE109A, ILE109B, ILE12A, ILE12B, ILE4A, ILE4B, ILE65A, ILE65B, ILE88A, ILE88B, LEU10A, LEU10B, LEU59A, LEU59B, LEU83A, LEU83B, LEU85A, LEU85B, LEU96A, LEU96B, LEU97A, LEU97B, LYS108A, LYS108B, LYS44B, LYS52A, LYS52B, LYS62A, LYS62B, LYS9A, LYS9B, MET1A, MET1B, PHE70A, PHE70B, PHE7A, PHE7B, PRO102A, PRO102B, PRO104A, PRO104B, PRO71A, PRO71B, PRO72A, PRO72B, PRO89A, PRO89B, PRO99A, PRO99B, THR107A, THR107B, THR14A, THR14B, TYR54A, TYR54B, VAL103A, VAL103B, VAL3A, VAL3B, VAL64A, VAL64B, VAL67A, VAL67B, VAL68A, VAL68B, VAL84A, VAL84B, VAL94A, VAL94B, VAL95A, VAL95B
• A-C: ARG53A, ARG53C, ASN61A, ASN61C, ASP100A, ASP100C, ASP93A, ASP93C, GLN101A, GLN101C, GLN98A, GLN98C, GLU22A, GLU22C, GLU57A, GLU57C, GLY58A, GLY58C, ILE31A, ILE31C, ILE50A, ILE50C, ILE60A, ILE60C, LEU59A, LEU59C, LYS52A, LYS52C, LYS55A, LYS55C, LYS62A, LYS62C, PRO29A, PRO56A, PRO56C, THR51A, THR51C, TYR54A, TYR54C, VAL94A, VAL94C, VAL95A, VAL95C
• A-D: ASN61A, ASN61D, ASP100A, ASP100D, GLN101A, GLN101D, GLN63A, GLN63D, GLN98A, GLN98D, GLU57A, GLU57D, GLY58A, GLY58D, ILE60A, ILE60D, LEU59A, LEU59D, LYS55A, LYS55D, LYS62A, LYS62D, PRO102A, PRO102D, PRO104A, PRO104D, PRO56A, PRO56D, PRO99A, THR16A, THR16D, TYR54A, TYR54D, VAL103A, VAL103D
• B-C: ASN61B, ASN61C, ASP100B, ASP100C, GLN101B, GLN101C, GLN63B, GLN63C, GLN98B, GLN98C, GLU57B, GLU57C, GLY58B, GLY58C, ILE17B, ILE60B, ILE60C, LEU59B, LEU59C, LYS55C, LYS62B, LYS62C, PRO102B, PRO102C, PRO104B, PRO104C, PRO56C, PRO99C, THR16B, THR16C, TYR54B, TYR54C, VAL103B, VAL103C
• B-D: ARG53B, ARG53D, ASN61B, ASN61D, ASP100B, ASP100D, ASP93B, ASP93D, GLN101B, GLN98B, GLN98D, GLU22B, GLU57B, GLU57D, GLY58B, GLY58D, ILE31B, ILE31D, ILE50B, ILE50D, ILE60B, ILE60D, LEU59B, LEU59D, LYS52B, LYS52D, LYS55B, LYS55D, LYS62B, LYS62D, PRO29B, PRO29D, PRO56B, PRO56D, THR51B, THR51D, TYR54B, TYR54D, VAL94B, VAL94D, VAL95B, VAL95D
• C-D: ALA2C, ALA2D, ALA66C, ALA66D, ARG13C, ARG13D, ARG53C, ARG53D, ARG73C, ARG73D, ASN69C, ASN69D, ASP100C, ASP100D, ASP11C, ASP11D, ASP5C, ASP5D, ASP6C, ASP6D, ASP93C, ASP93D, GLN101C, GLN101D, GLN63C, GLN63D, GLN98C, GLN98D, GLU8C, GLU8D, GLY106C, GLY106D, GLY110C, GLY110D, GLY86C, GLY86D, GLY87C, GLY87D, GLY90C, GLY90D, HIS0D, ILE109C, ILE109D, ILE12C, ILE12D, ILE4C, ILE4D, ILE65C, ILE65D, ILE88C, ILE88D, LEU10C, LEU10D, LEU59C, LEU59D, LEU83C, LEU83D, LEU85C, LEU85D, LEU96C, LEU96D, LEU97C, LEU97D, LYS108C, LYS108D, LYS44D, LYS52C, LYS62C, LYS62D, LYS9C, LYS9D, MET1C, MET1D, PHE70C, PHE70D, PHE7C, PHE7D, PRO102C, PRO102D, PRO104C, PRO104D, PRO71C, PRO71D, PRO72C, PRO72D, PRO89C, PRO89D, PRO99C, PRO99D, THR107C, THR107D, THR14C, THR14D, TYR54C, TYR54D, VAL103C, VAL103D, VAL3C, VAL3D, VAL64C, VAL64D, VAL67C, VAL67D, VAL68C, VAL68D, VAL84C, VAL84D, VAL94C, VAL94D, VAL95C, VAL95D