3OXQ

crystal structure of ca2+/cam-cav1.2 pre-iq/iq domain complex

• Total interactions analyzed: 15
• Total true interactions: 10
• Strongest Interaction:
  • Chains: C-F
  • Int. Res.: 103
  • Norm. En. per Res.: -4.2698
• 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-D	0.0	0.0	-0.7912	-0.7912	12	0	0	154	0	14	17
A-E	-7.9536	-72.6158	-318.261	-398.8304	105	11	10	13140	4	45	17
B-C	0.0	0.0	-0.3088	-0.3088	10	0	0	107	0	14	16
B-D	0.0	14.3088	-8.6109	5.6979	8	0	0	320	0	13	25
B-E	0.0	3.3438	-133.704	-130.3602	70	9	6	7625	0	14	21
B-F	-7.4944	-23.3132	-117.786	-148.5936	59	5	4	4967	3	37	21
C-F	-12.6692	-85.2316	-341.89	-439.7908	103	17	10	14148	4	46	17
D-E	0.0	-25.4215	-101.785	-127.2065	57	1	4	4325	1	37	20
D-F	0.0	3.4236	-145.67	-142.2464	72	7	6	7456	0	14	21
E-F	0.0	13.6234	-86.0352	-72.4119	57	1	10	5356	0	17	28

Interface residues

• A-D: ALA103A, ARG106A, ARG37A, ARG74D, ASN97A, ASP95A, GLU104A, GLU82D, GLU83D, GLU84D, GLU87D, SER101A
• A-E: ALA10A, ALA128A, ALA147A, ALA15A, ALA1620E, ALA73A, ALA88A, ARG106A, ARG126A, ARG1629E, ARG1634E, ARG74A, ARG86A, ARG90A, ASN111A, ASP122A, ASP50A, ASP78A, ASP93A, GLN143A, GLN1625E, GLN41A, GLN8A, GLU104A, GLU114A, GLU119A, GLU11A, GLU120A, GLU123A, GLU127A, GLU14A, GLU1626E, GLU47A, GLU54A, GLU7A, GLU82A, GLU83A, GLU84A, GLU87A, GLY113A, GLY1616E, HIS107A, ILE100A, ILE125A, ILE1624E, ILE27A, ILE52A, ILE63A, ILE85A, ILE9A, LEU105A, LEU112A, LEU116A, LEU1623E, LEU18A, LEU32A, LEU39A, LEU48A, LYS115A, LYS13A, LYS1617E, LYS1630E, LYS1632E, LYS75A, LYS77A, MET109A, MET124A, MET144A, MET145A, MET36A, MET51A, MET71A, MET72A, MET76A, PHE12A, PHE141A, PHE1618E, PHE1622E, PHE1628E, PHE1631E, PHE16A, PHE19A, PHE68A, PHE89A, PHE92A, PRO43A, SER17A, SER81A, THR110A, THR117A, THR146A, THR1614E, THR1621E, THR28A, THR29A, THR79A, TYR1619E, TYR1627E, VAL108A, VAL121A, VAL136A, VAL1615E, VAL35A, VAL55A, VAL91A
• B-C: ALA103C, ARG37C, ARG74B, ASP95C, GLU104C, GLU82B, GLU83B, GLU87B, LYS94C, SER101C
• B-D: ARG126B, ARG126D, ASP122B, ASP122D, GLU123B, GLU123D, GLU127B, GLU127D
• B-E: ALA1564E, ALA1569E, ALA1581E, ALA15B, ALA73B, ARG126B, ARG1567E, ARG1571E, ARG1586E, ARG37B, ARG74B, ASN1582E, ASN53B, ASP50B, ASP56B, GLN41B, GLU119B, GLU11B, GLU120B, GLU123B, GLU14B, GLU1575E, GLU1579E, GLU31B, GLU47B, GLU54B, GLU67B, GLY1560E, GLY33B, ILE1572E, ILE27B, ILE52B, ILE63B, LEU116B, LEU1562E, LEU1565E, LEU1570E, LEU1578E, LEU1585E, LEU18B, LEU32B, LEU39B, LEU48B, LYS115B, LYS13B, LYS1573E, LYS75B, MET124B, MET36B, MET51B, MET71B, MET72B, MET76B, PHE12B, PHE1563E, PHE16B, PHE19B, PHE68B, PRO43B, SER17B, SER38B, THR117B, THR1561E, THR1568E, THR1574E, THR34B, VAL121B, VAL1566E, VAL35B, VAL55B
• B-F: ALA102B, ALA128B, ALA1587F, ALA15B, ALA88B, ARG126B, ARG1586F, ARG1595F, ASN1582F, ASP122B, ASP129B, ASP1602F, GLN143B, GLN8B, GLU11B, GLU120B, GLU123B, GLU127B, GLU14B, GLU1583F, GLU7B, GLU84B, GLU87B, ILE100B, ILE125B, ILE1588F, ILE1589F, ILE1592F, ILE85B, LEU105B, LEU116B, LEU1585F, LEU1600F, LEU1601F, LYS115B, LYS1590F, LYS1591F, LYS1594F, LYS1599F, LYS75B, MET109B, MET124B, MET144B, MET145B, MET1598F, MET72B, MET76B, PHE12B, PHE141B, PHE89B, SER101B, SER1597F, THR146B, THR1596F, TRP1593F, VAL108B, VAL121B, VAL136B, VAL91B
• C-F: ALA10C, ALA128C, ALA147C, ALA15C, ALA1620F, ALA73C, ALA88C, ARG106C, ARG126C, ARG1629F, ARG1634F, ARG74C, ARG86C, ARG90C, ASN111C, ASP122C, ASP50C, ASP78C, ASP93C, GLN143C, GLN1625F, GLN41C, GLN8C, GLU104C, GLU114C, GLU119C, GLU11C, GLU120C, GLU123C, GLU127C, GLU14C, GLU1626F, GLU47C, GLU54C, GLU7C, GLU82C, GLU83C, GLU84C, GLU87C, GLY113C, GLY1616F, ILE100C, ILE125C, ILE1624F, ILE27C, ILE52C, ILE63C, ILE85C, LEU105C, LEU112C, LEU116C, LEU1623F, LEU18C, LEU32C, LEU39C, LEU48C, LYS115C, LYS13C, LYS1617F, LYS1630F, LYS1632F, LYS75C, LYS77C, MET109C, MET124C, MET144C, MET145C, MET36C, MET51C, MET71C, MET72C, MET76C, PHE12C, PHE141C, PHE1618F, PHE1622F, PHE1628F, PHE1631F, PHE16C, PHE19C, PHE68C, PHE89C, PHE92C, PRO43C, SER17C, SER81C, THR110C, THR117C, THR146C, THR1614F, THR1621F, THR28C, THR29C, THR79C, TYR1619F, TYR1627F, VAL108C, VAL121C, VAL136C, VAL1615F, VAL35C, VAL55C, VAL91C
• D-E: ALA102D, ALA128D, ALA1587E, ALA88D, ARG126D, ARG1586E, ARG1595E, ASN1582E, ASP122D, ASP129D, ASP1602E, GLN135D, GLN143D, GLN8D, GLU104D, GLU11D, GLU120D, GLU123D, GLU127D, GLU14D, GLU1583E, GLU84D, GLU87D, ILE125D, ILE1588E, ILE1589E, ILE1592E, ILE85D, LEU105D, LEU116D, LEU1585E, LEU1600E, LEU1601E, LYS115D, LYS1590E, LYS1591E, LYS1594E, LYS1599E, LYS75D, MET109D, MET124D, MET144D, MET145D, MET1598E, MET76D, PHE12D, PHE141D, PHE89D, SER101D, SER1597E, THR146D, THR1596E, TRP1593E, VAL108D, VAL121D, VAL136D, VAL91D
• D-F: ALA1564F, ALA1569F, ALA1581F, ALA15D, ALA73D, ARG126D, ARG1567F, ARG1571F, ARG1586F, ARG37D, ARG74D, ASN1577F, ASN1582F, ASN53D, ASP50D, ASP56D, GLN41D, GLU119D, GLU11D, GLU120D, GLU123D, GLU14D, GLU1575F, GLU1579F, GLU31D, GLU47D, GLU54D, GLU67D, GLY1560F, GLY33D, ILE1572F, ILE27D, ILE52D, ILE63D, LEU116D, LEU1562F, LEU1565F, LEU1570F, LEU1578F, LEU1585F, LEU18D, LEU32D, LEU39D, LEU48D, LYS115D, LYS13D, LYS1573F, LYS75D, MET109D, MET124D, MET36D, MET51D, MET71D, MET72D, MET76D, PHE12D, PHE1563F, PHE16D, PHE19D, PHE68D, PRO43D, SER17D, SER38D, THR117D, THR1561F, THR1568F, THR1574F, THR34D, VAL121D, VAL1566F, VAL35D, VAL55D
• E-F: ALA1581E, ALA1581F, ALA1587E, ALA1587F, ARG1567E, ARG1567F, ARG1571E, ARG1571F, ARG1586E, ARG1586F, ARG1595E, ARG1595F, ASN1577E, ASN1577F, ASN1582E, ASN1582F, ASP1602E, ASP1602F, GLN1580E, GLN1580F, GLU1575E, GLU1575F, GLU1579E, GLU1579F, GLU1583E, GLU1583F, GLU1584E, GLU1584F, GLY1576E, GLY1576F, ILE1588E, ILE1588F, ILE1589E, ILE1589F, ILE1592E, ILE1592F, LEU1570E, LEU1570F, LEU1578E, LEU1578F, LEU1585E, LEU1585F, LYS1573E, LYS1573F, LYS1591E, LYS1591F, LYS1599E, LYS1599F, MET1598E, MET1598F, PHE1563E, PHE1563F, THR1574E, THR1574F, TRP1593E, TRP1593F, VAL1566E