3JZT

structure of a cubic crystal form of x (adrp) domain from fcov with adp-ribose

• Total interactions analyzed: 28
• Total true interactions: 16
• Strongest Interaction:
  • Chains: E-G
  • Int. Res.: 45
  • Norm. En. per Res.: -4.007
• Hub Node: B(4)

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	-10.7927	2.0524	-134.564	-143.3043	50	2	0	4883	0	23	25
A-C	-7.5578	9.1593	-32.6923	-31.0908	34	0	0	1885	0	19	25
B-C	-14.0308	-19.4791	-69.4539	-102.9638	39	2	1	3298	1	12	8
B-D	-17.2906	-49.6489	-57.7715	-124.7111	41	1	2	2977	3	12	8
B-E	-10.3629	0.3943	-68.9886	-78.9573	35	5	1	2990	0	7	7
B-F	0.0	0.0	-3.0434	-3.0434	10	0	0	160	0	5	5
C-D	-7.8666	-20.6996	-39.3587	-67.9249	35	0	2	2508	0	13	6
C-E	-6.1255	-5.8207	-102.002	-113.9483	47	22	1	4688	1	9	10
D-E	-2.8692	4.1639	-26.6249	-25.3301	23	5	1	1656	0	6	8
D-F	0.0	0.0	-21.7447	-21.7447	23	0	0	1001	0	3	4
D-G	0.0	4.6249	-13.9542	-9.3293	18	1	0	680	0	3	6
E-F	-10.4652	-57.8665	-88.1574	-156.4891	46	0	2	3743	3	13	9
E-G	-30.328	-67.8807	-82.1061	-180.3148	45	9	2	3976	4	12	9
E-H	-17.6018	8.2658	-37.7372	-47.0732	31	4	0	1892	0	20	23
F-G	-11.3039	-54.5214	-68.8993	-134.7247	43	7	2	3456	5	12	8
G-H	-13.4268	-2.0944	-134.255	-149.7763	51	3	0	5012	1	23	24

Interface residues

• A-B: ALA103A, ARG93A, ARG93B, ASN114A, ASN114B, ASN123A, ASN57B, ASP53B, ASP62B, GLU113A, GLU113B, GLU117B, GLU60B, GLU96A, GLY87B, HIS118B, ILE104A, ILE56B, LEU111A, LEU116B, LEU119B, LEU153B, LEU55B, LEU59B, LEU64B, LEU72A, LEU90A, LEU98A, LYS102A, LYS151B, LYS89B, LYS92A, LYS95A, LYS99A, PHE112A, PHE58B, PHE85B, PRO61B, SER100A, SER101A, SER120B, SER94A, THR86B, TYR97A, VAL110A, VAL115A, VAL115B, VAL121A, VAL63B, VAL84B
• A-C: ALA103A, ALA103C, ARG73A, ARG73C, ARG80A, ARG80C, ASP71A, ASP71C, ASP83A, GLU96A, GLU96C, HIS74A, HIS74C, LEU98A, LEU98C, LYS102A, LYS102C, LYS92A, LYS92C, LYS95A, LYS95C, LYS99A, LYS99C, SER100A, SER100C, SER101A, SER101C, SER94A, THR91A, THR91C, TYR97A, TYR97C, VAL75A, VAL75C
• B-C: ALA79C, ALA81B, ALA81C, ARG128C, ARG73C, ARG80C, ASN129C, ASN57B, ASN69C, ASP34B, ASP51B, ASP53B, ASP71C, GLU60B, GLY160C, GLY50B, GLY76C, GLY77C, GLY87B, HIS74C, ILE161C, ILE36B, ILE56B, LEU35B, LEU37B, LEU52B, LEU55B, LYS163C, PHE162C, PHE58B, PHE85B, PRO38B, TYR187B, TYR187C, VAL164C, VAL54B, VAL75C, VAL84B, VAL84C
• B-D: ALA81D, ARG128B, ARG73B, ARG80B, ASN129B, ASN57D, ASN69B, ASP131B, ASP189D, ASP34D, ASP51D, ASP53D, GLN190B, GLN49D, GLU60D, GLY160B, GLY50D, GLY76B, GLY77B, HIS74B, ILE161B, ILE36D, ILE56D, LEU35D, LEU37D, LEU52D, LEU55D, LYS163B, PHE162B, PHE58D, PHE85D, PRO38D, THR188B, TYR187B, TYR187D, TYR48D, VAL164B, VAL54D, VAL75B, VAL84B, VAL84D
• B-E: ALA42E, ARG192B, ARG192E, ASN197B, ASN200B, ASN200E, ASP189B, ASP34E, GLN190B, GLN49B, GLU167B, GLU191B, GLU196B, GLU196E, GLY201B, GLY43E, ILE36E, LEU35E, LEU37E, LYS151E, LYS41E, PHE198B, PHE199E, PHE39B, PHE39E, PHE47E, PRO38E, SER46E, THR188B, THR194B, TYR187B, TYR40E, TYR48E, VAL193B, VAL45E
• B-F: ASN129B, ASN129F, ASN197B, ASP131F, GLU167B, GLY130F, LYS163F, LYS165B, LYS165F, THR194B
• C-D: ARG128D, ARG73D, ARG80D, ASN129D, ASN57C, ASN69D, ASP131D, ASP34C, ASP51C, ASP53C, GLN49C, GLU60C, GLY160D, GLY76D, GLY77D, HIS74D, ILE161D, ILE36C, ILE56C, LEU35C, LEU37C, LEU52C, LEU55C, LYS163D, PHE162D, PHE58C, PHE85C, TYR187C, TYR187D, TYR48C, VAL164D, VAL54C, VAL75D, VAL84C, VAL84D
• C-E: ALA42E, ARG133E, ARG192C, ASN197C, ASN197E, ASN200C, ASN200E, ASP189C, ASP51C, CYS139E, CYS172E, GLN171E, GLN190C, GLN49C, GLU135E, GLU167C, GLU167E, GLU191C, GLU196C, GLU196E, GLY136E, GLY201C, GLY201E, ILE195C, ILE195E, LEU166C, LEU166E, LEU170E, LEU173E, LEU174E, LYS165C, LYS165E, LYS175E, PHE198C, PHE198E, PHE199C, PHE199E, SER169E, THR178E, THR188C, THR194C, THR194E, TYR187C, TYR40E, VAL134E, VAL168E, VAL193C
• D-E: ARG192D, ARG192E, ASN197D, ASN197E, ASN200E, ASP189D, ASP189E, GLN190D, GLN190E, GLU167D, GLU191D, GLU191E, GLU196D, GLU196E, GLY201E, ILE195D, PHE198D, THR188D, THR188E, THR194D, THR194E, VAL193D, VAL193E
• D-F: ARG192D, ARG192F, ASN197D, ASN197F, ASN200D, ASN200F, ASP189F, GLN190F, GLN49F, GLU191F, GLU196D, GLU196F, GLY201D, LEU37D, LYS165F, LYS41D, PHE199D, PHE39D, PRO38D, THR188F, TYR40D, VAL193D, VAL193F
• D-G: ARG192G, ASN197D, ASN197G, ASN200D, ASP189G, GLN171D, GLN190G, GLU167D, GLU191G, GLU196D, GLU196G, GLY201D, ILE195D, LYS165D, PHE198D, PHE199D, THR188G, VAL193G
• E-F: ALA68F, ALA79F, ALA81E, ALA81F, ARG128F, ARG73F, ARG80F, ASN129F, ASN57E, ASN69F, ASP131F, ASP189E, ASP34E, ASP51E, ASP53E, ASP71F, GLN190F, GLU60E, GLY160F, GLY50E, GLY70F, GLY76F, GLY77F, HIS74F, ILE161F, ILE36E, ILE56E, LEU35E, LEU37E, LEU52E, LEU55E, LEU72F, LYS163F, PHE162F, PHE39E, PHE58E, PHE85E, PRO38E, TYR187E, TYR48E, VAL164F, VAL54E, VAL75F, VAL78F, VAL84E, VAL84F
• E-G: ALA68E, ALA79E, ALA81E, ALA81G, ARG128E, ARG73E, ARG80E, ASN129E, ASN57G, ASN69E, ASP131E, ASP189G, ASP34G, ASP51G, ASP53G, ASP71E, GLN190E, GLN49G, GLU60G, GLY160E, GLY50G, GLY70E, GLY76E, GLY77E, HIS74E, ILE161E, ILE36G, ILE56G, LEU35G, LEU37G, LEU52G, LEU55G, LEU72E, LYS163E, PHE162E, PHE58G, PHE85G, PRO38G, TYR187G, TYR48G, VAL54G, VAL75E, VAL78E, VAL84E, VAL84G
• E-H: ALA103E, ALA103H, ARG73E, ARG73H, ASP71E, ASP71H, GLU96E, GLU96H, HIS74E, HIS74H, LEU98E, LEU98H, LYS102E, LYS102H, LYS92E, LYS92H, LYS95E, LYS95H, LYS99E, LYS99H, SER100E, SER100H, SER101E, SER101H, SER94E, THR91E, THR91H, TYR97E, TYR97H, VAL75E, VAL75H
• F-G: ALA79G, ALA81F, ALA81G, ARG128G, ARG73G, ARG80F, ARG80G, ASN129G, ASN57F, ASN69G, ASP189F, ASP34F, ASP51F, ASP53F, ASP71G, GLN190G, GLN49F, GLU60F, GLY160G, GLY50F, GLY70G, GLY76G, GLY77G, HIS74G, ILE161G, ILE36F, ILE56F, LEU35F, LEU37F, LEU52F, LEU55F, LYS163G, PHE162G, PHE58F, PHE85F, PRO38F, TYR187F, TYR48F, VAL54F, VAL75G, VAL78G, VAL84F, VAL84G
• G-H: ALA103H, ARG93G, ARG93H, ASN114G, ASN114H, ASN123H, ASN57G, ASP53G, ASP62G, GLU113G, GLU113H, GLU117G, GLU60G, GLU96H, GLY87G, GLY88G, HIS118G, ILE104H, ILE56G, LEU111H, LEU116G, LEU119G, LEU55G, LEU59G, LEU64G, LEU72H, LEU90H, LEU98H, LYS102H, LYS151G, LYS89G, LYS92G, LYS92H, LYS95H, LYS99H, PHE112H, PHE58G, PHE85G, PRO61G, SER100H, SER101H, SER120G, SER94H, THR86G, TYR97H, VAL110H, VAL115G, VAL115H, VAL121H, VAL63G, VAL84G