3C01

crystal structural of native spas c-terminal domain

• Total interactions analyzed: 28
• Total true interactions: 15
• Strongest Interaction:
  • Chains: A-E
  • Int. Res.: 85
  • Norm. En. per Res.: -5.8395
• Hub Node: A(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-E	-130.9728	-12.8204	-352.567	-496.3603	85	12	33	15020	3	24	12
A-B	0.0	0.0	-0.5507	-0.5507	7	0	0	59	0	0	0
A-F	0.0	0.0	-0.0003	-0.0003	2	0	0	1	0	0	0
A-G	0.0	3.9021	-8.9805	-5.0784	18	0	0	643	0	4	6
E-B	-14.2847	2.8397	-33.1922	-44.6372	21	1	0	1377	0	8	7
E-F	0.0	-2.5811	-50.8952	-53.4763	39	1	4	2849	0	6	6
E-G	-10.7515	-30.1158	-29.8187	-70.686	25	3	0	1242	4	8	6
E-H	-27.843	-56.295	-26.8188	-110.9568	24	4	0	1052	4	15	15
B-F	-113.4659	-16.8355	-347.328	-477.6294	82	13	32	15072	3	23	12
C-G	-131.398	-13.5539	-337.132	-482.0839	84	10	34	14513	3	21	11
C-D	0.0	0.0	-0.6883	-0.6883	7	0	0	66	0	0	0
C-H	0.0	0.0	-0.0003	-0.0003	2	0	0	1	0	0	0
G-D	-21.2427	-2.1976	-30.6311	-54.0714	21	2	0	1270	0	8	7
G-H	0.0	0.4879	-41.2766	-40.7886	40	2	3	2399	0	5	6
D-H	-132.3299	-8.4154	-332.505	-473.2503	82	16	32	14822	2	20	11

Interface residues

• A-E: ALA257A, ALA287E, ALA289E, ALA292E, ALA294E, ALA308E, ARG253A, ARG286E, ARG291E, ARG309E, ARG317E, ASN251A, ASN258A, ASN284E, ASN341E, ASP248A, ASP304E, GLN244A, GLN285E, GLU239A, GLU243A, GLU250A, GLU282E, GLU295E, GLU328E, GLU337E, GLU338E, GLU340E, GLY265E, GLY298E, HIS261E, ILE240A, ILE249A, ILE255A, ILE262E, ILE264E, ILE266E, ILE278E, ILE302E, ILE305E, LEU241A, LEU254A, LEU288E, LEU307E, LEU311E, LEU330E, LEU332E, LEU333E, LEU336E, LYS246A, LYS269E, LYS296E, LYS306E, LYS344E, MET277E, PHE268E, PHE312E, PRO259E, PRO270E, PRO276E, PRO300E, SER242A, SER247A, SER252A, SER279E, SER310E, THR260E, THR263E, THR283E, TRP335E, TYR267E, TYR281E, TYR293E, TYR318E, VAL245A, VAL256A, VAL280E, VAL290E, VAL297E, VAL299E, VAL301E, VAL303E, VAL329E, VAL334E, VAL339E
• A-B: ALA257A, ASN251B, ASN258A, GLN244B, GLU243B, GLU250B, SER247B
• A-F: ARG253A, LEU272F
• A-G: ARG331G, ASP327G, CB9.9749515.60835, GLN244A, GLU239A, GLU239A5, GLU243A, GLU328G, ILE240A, ILE326G, LEU241A, LEU323G, LEU330G, LYS246A, PHE268G, SER242A, VAL245A, VAL334G
• E-B: ALA308E, ARG291E, ARG309E, ASN251B, ASP248B, ASP304E, GLN244B, GLU243B, GLU250B, GLU295E, HIS261E, ILE302E, ILE305E, LEU307E, LYS246B, LYS306E, SER242B, SER247B, VAL245B, VAL301E, VAL303E
• E-F: ALA294E, ALA342E, ARG291E, ASN341E, ASP304E, ASP319F, ASP345E, GLU271F, GLU295E, GLU337E, GLU338E, GLU340E, GLY298E, GLY343E, ILE275F, ILE302E, ILE326F, LEU272F, LEU320F, LEU323F, LEU330F, LEU336E, LYS269F, LYS296E, LYS344E, MET273F, MET277F, PRO274F, PRO276F, PRO300E, TRP335E, TYR267F, TYR318F, VAL297E, VAL299E, VAL301E, VAL303E, VAL339E, VAL346E
• E-G: ARG286E, ARG317E, ARG331G, ASN284E, ASP327G, GLN285E, GLU282E, GLU328G, GLU337G, GLU338G, ILE326G, LEU330G, LEU332G, LEU333G, PHE312E, PRO259E, THR260E, THR283E, TRP335G, TYR281E, TYR318E, VAL280E, VAL290E, VAL329G, VAL334G
• E-H: ARG316E, ARG316H, ARG317E, ARG317H, ASP319E, ASP319H, GLU324E, GLU324H, HIS315E, HIS315H, ILE278E, ILE278H, LEU320E, LEU320H, LYS313E, LYS313H, PHE312E, SER322E, SER322H, THR314E, THR314H, TYR281E, TYR318E, TYR318H
• B-F: ALA257B, ALA287F, ALA289F, ALA292F, ALA294F, ALA308F, ARG253B, ARG286F, ARG291F, ARG309F, ARG317F, ASN251B, ASN258B, ASN284F, ASN341F, ASP248B, ASP304F, GLN244B, GLN285F, GLU239B, GLU243B, GLU250B, GLU282F, GLU295F, GLU337F, GLU338F, GLU340F, GLY265F, GLY298F, HIS261F, ILE240B, ILE249B, ILE255B, ILE262F, ILE264F, ILE266F, ILE278F, ILE302F, ILE305F, LEU241B, LEU254B, LEU288F, LEU307F, LEU311F, LEU332F, LEU333F, LEU336F, LYS246B, LYS269F, LYS296F, LYS306F, MET277F, PHE268F, PHE312F, PRO259F, PRO270F, PRO276F, PRO300F, SER242B, SER247B, SER252B, SER279F, SER310F, THR260F, THR263F, THR283F, TRP335F, TYR267F, TYR281F, TYR293F, TYR318F, VAL245B, VAL256B, VAL280F, VAL290F, VAL297F, VAL299F, VAL301F, VAL303F, VAL329F, VAL334F, VAL339F
• C-G: ALA257C, ALA287G, ALA289G, ALA292G, ALA294G, ALA308G, ARG253C, ARG286G, ARG291G, ARG309G, ARG317G, ARG331G, ASN251C, ASN258C, ASN284G, ASN341G, ASP248C, ASP304G, GLN244C, GLN285G, GLU243C, GLU250C, GLU282G, GLU295G, GLU328G, GLU337G, GLU338G, GLU340G, GLY265G, GLY298G, HIS261G, ILE240C, ILE249C, ILE255C, ILE262G, ILE264G, ILE266G, ILE278G, ILE302G, ILE305G, LEU241C, LEU254C, LEU288G, LEU307G, LEU311G, LEU330G, LEU332G, LEU333G, LEU336G, LYS246C, LYS269G, LYS296G, LYS306G, MET277G, PHE268G, PHE312G, PRO259G, PRO270G, PRO276G, PRO300G, SER242C, SER247C, SER252C, SER279G, SER310G, THR260G, THR263G, THR283G, TRP335G, TYR267G, TYR281G, TYR293G, TYR318G, VAL245C, VAL256C, VAL280G, VAL290G, VAL297G, VAL299G, VAL301G, VAL303G, VAL329G, VAL334G, VAL339G
• C-D: ALA257C, ASN251D, ASN258C, GLN244D, GLU243D, GLU250D, SER247D
• C-H: LEU254C, LEU272H
• G-D: ALA308G, ARG291G, ARG309G, ASN251D, ASP248D, ASP304G, GLN244D, GLU243D, GLU250D, GLU295G, HIS261G, ILE302G, ILE305G, LEU307G, LYS246D, LYS306G, SER242D, SER247D, VAL245D, VAL301G, VAL303G
• G-H: ALA294G, ALA342G, ARG291G, ASN341G, ASP304G, ASP319H, ASP345G, GLU271H, GLU295G, GLU337G, GLU338G, GLU340G, GLY298G, GLY343G, ILE275H, ILE278H, ILE302G, ILE305G, LEU272H, LEU320H, LEU323H, LEU332G, LEU336G, LYS269H, LYS296G, LYS344G, MET273H, MET277H, PRO274H, PRO276H, PRO300G, TRP335G, TYR267H, TYR318H, VAL297G, VAL299G, VAL301G, VAL303G, VAL321H, VAL339G
• D-H: ALA257D, ALA287H, ALA289H, ALA292H, ALA294H, ALA308H, ARG253D, ARG286H, ARG291H, ARG309H, ARG317H, ASN251D, ASN258D, ASN284H, ASN341H, ASP248D, ASP304H, GLN244D, GLN285H, GLU243D, GLU250D, GLU271H, GLU282H, GLU295H, GLU337H, GLU338H, GLU340H, GLY265H, GLY298H, HIS261H, ILE240D, ILE249D, ILE255D, ILE262H, ILE264H, ILE266H, ILE278H, ILE302H, ILE305H, LEU241D, LEU254D, LEU288H, LEU307H, LEU311H, LEU332H, LEU333H, LEU336H, LYS246D, LYS269H, LYS296H, LYS306H, MET277H, PHE268H, PHE312H, PRO259H, PRO270H, PRO276H, PRO300H, SER242D, SER247D, SER252D, SER279H, SER310H, THR260H, THR263H, THR283H, TRP335H, TYR267H, TYR281H, TYR293H, TYR318H, VAL245D, VAL256D, VAL280H, VAL290H, VAL297H, VAL299H, VAL301H, VAL303H, VAL329H, VAL334H, VAL339H