3QVZ

crystal structure of the zn-ridc1 complex stabilized by bmoe crosslinks cocrystallized in the presence of cu(ii)

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 30
  • Norm. En. per Res.: -5.0994
• 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	-6.4337	-57.5214	-63.9551	69	6	2	3269	4	37	35
A-C	-17.2197	-65.0866	-70.6753	-152.9816	30	0	0	2077	6	16	16
A-D	0.0	78.1676	-143.591	-65.4234	72	12	2	6426	0	30	29
B-C	0.0	77.144	-150.887	-73.743	72	12	2	6454	0	30	29
B-D	-8.6498	-64.8589	-67.1106	-140.6193	30	1	0	2033	7	16	16
C-D	0.0	-4.6821	-58.9272	-63.6093	69	2	2	3077	4	38	35

Interface residues

• A-B: ALA100A, ALA100B, ALA75A, ALA75B, ALA87A, ALA87B, ALA89A, ALA89B, ALA90A, ALA90B, ASN99A, ASN99B, ASP60A, ASP60B, ASP74A, ASP74B, CYS101A, CYS101B, CYS98B, GLN103A, GLN103B, GLN71A, GLN71B, GLN88B, GLN93A, GLN93B, GLU57A, GLU57B, GLU81A, GLU81B, GLU86A, GLU86B, GLU92A, GLU92B, GLY64A, GLY64B, GLY70A, GLY70B, HIS59A, HIS59B, HIS63A, HIS63B, HIS77A, HIS77B, ILE67A, ILE67B, LEU78A, LEU78B, LEU94A, LEU94B, LYS104A, LYS104B, LYS83A, LYS83B, LYS85A, LYS85B, LYS95A, LYS95B, PHE61B, PRO56A, PRO56B, THR96A, THR96B, THR97A, THR97B, TRP66A, TRP66B, TYR105A, TYR105B
• A-C: ALA75A, ALA75C, ALA79A, ALA79C, ASN80A, ASN80C, ASP74A, ASP74C, CYS82A, CYS82C, GLN71A, GLN71C, GLU81A, GLU81C, GLU86A, GLU86C, GLY70A, GLY70C, HIS73A, HIS73C, HIS77A, HIS77C, LEU76A, LEU76C, LEU78A, LEU78C, LYS27A, LYS27C, LYS83A, LYS83C
• A-D: ALA24A, ALA24D, ALA34A, ALA34D, ALA35A, ALA35D, ALA36A, ALA36D, ALA37A, ALA37D, ALA38A, ALA38D, ALA40A, ALA40D, ARG62A, ARG62D, ASN80A, ASN80D, ASP28A, ASP28D, ASP39A, ASP39D, ASP54A, ASP54D, ASP60A, ASP60D, ASP74A, ASP74D, GLY70A, GLY70D, HIS59A, HIS59D, HIS63A, HIS63D, HIS73A, HIS73D, HIS77A, HIS77D, ILE67A, ILE67D, ILE69A, ILE69D, ILE72A, ILE72D, LEU30A, LEU30D, LEU68A, LEU68D, LEU76A, LEU76D, LYS27A, LYS27D, LYS32A, LYS32D, MET33A, MET33D, MET58A, MET58D, PHE65A, PHE65D, PRO53A, PRO53D, PRO56A, PRO56D, SER42A, SER42D, THR31A, THR31D, TRP41A, TRP41D, TRP66A, TRP66D
• B-C: ALA1B, ALA24C, ALA34B, ALA34C, ALA35B, ALA35C, ALA36B, ALA36C, ALA37B, ALA37C, ALA38B, ALA38C, ALA40B, ALA40C, ARG62B, ARG62C, ASN80B, ASN80C, ASP28B, ASP28C, ASP39B, ASP39C, ASP54B, ASP54C, ASP60B, ASP60C, ASP74B, ASP74C, GLY70B, GLY70C, HIS59B, HIS59C, HIS63B, HIS63C, HIS73B, HIS73C, HIS77B, HIS77C, ILE67B, ILE67C, ILE69B, ILE69C, ILE72B, ILE72C, LEU30B, LEU30C, LEU68B, LEU68C, LEU76B, LEU76C, LYS27B, LYS27C, LYS32B, LYS32C, MET33B, MET33C, MET58B, MET58C, PHE65B, PHE65C, PRO53B, PRO53C, PRO56B, PRO56C, SER42B, SER42C, THR31B, THR31C, TRP41B, TRP41C, TRP66B, TRP66C
• B-D: ALA75B, ALA75D, ALA79B, ALA79D, ASN80B, ASN80D, ASP74B, ASP74D, CYS82B, CYS82D, GLN71B, GLN71D, GLU81B, GLU81D, GLU86B, GLU86D, GLY70B, GLY70D, HIS73B, HIS73D, HIS77B, HIS77D, LEU76B, LEU76D, LEU78B, LEU78D, LYS27B, LYS27D, LYS83B, LYS83D
• C-D: ALA100C, ALA100D, ALA75C, ALA75D, ALA87C, ALA87D, ALA89C, ALA89D, ALA90C, ALA90D, ASN99C, ASN99D, ASP60C, ASP60D, ASP74C, ASP74D, CYS101C, CYS101D, CYS98C, GLN103C, GLN103D, GLN71C, GLN71D, GLN93C, GLN93D, GLU57C, GLU57D, GLU81C, GLU81D, GLU86C, GLU86D, GLU92C, GLU92D, GLY64C, GLY64D, GLY70C, GLY70D, HIS59C, HIS59D, HIS63C, HIS63D, HIS77C, HIS77D, ILE67C, ILE67D, LEU78C, LEU78D, LEU94C, LEU94D, LYS104C, LYS104D, LYS83C, LYS83D, LYS85C, LYS85D, LYS95C, LYS95D, PHE61D, PRO56C, PRO56D, SER55D, THR96C, THR96D, THR97C, THR97D, TRP66C, TRP66D, TYR105C, TYR105D