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MK9

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CBROASsing1.43Å1.41Å
OASCAPsing1.36Å1.40Å
CAPCAOdoub1.39Å1.37ÅAromatic
CAPCAQsing1.39Å1.35ÅAromatic
CLRCAQsing1.74Å1.68Å
CAOCANsing1.39Å1.37ÅAromatic
CAQCALdoub1.39Å1.34ÅAromatic
CBICBJdoub1.38Å1.38ÅAromatic
CBICBHsing1.38Å1.38ÅAromatic
CBJCBKsing1.39Å1.37ÅAromatic
CANOATsing1.36Å1.41Å
CANCAMdoub1.39Å1.37ÅAromatic
CBHCBGdoub1.38Å1.36ÅAromatic
CALCAMsing1.39Å1.38ÅAromatic
CALNAIsing1.40Å1.48Å
CBSOATsing1.43Å1.41Å
OAKCAHdoub1.22Å1.22Å
CBKNBMsing1.40Å1.35Å
CBKCBLdoub1.39Å1.38ÅAromatic
NBMCBNsing1.35Å1.34Å
CAMCLUsing1.74Å1.69Å
NAICAHsing1.35Å1.34Å
NAICAJsing1.47Å1.45Å
CAHNAGsing1.34Å1.34Å
CBGCBLsing1.38Å1.38ÅAromatic
CBGCAWsing1.51Å1.45Å
CBNCBOsing1.47Å1.49Å
CBNOBQdoub1.22Å1.22Å
CBOCBPdoub1.33Å1.52Å
CAJC5sing1.51Å1.46Å
CAWNAGsing1.47Å1.48Å
NAGC4sing1.38Å1.37Å
C5C4doub1.40Å1.36ÅAromatic
C5C6sing1.37Å1.36ÅAromatic
C4N3sing1.33Å1.32ÅAromatic
C6N1doub1.33Å1.37ÅAromatic
N3C2doub1.33Å1.32ÅAromatic
N1C2sing1.33Å1.31ÅAromatic
C2NAVsing1.38Å1.42Å
CAXNAVsing1.46Å1.45Å
CAOH1sing1.08Å1.08Å
CBSH2sing1.09Å1.10Å
CBSH3sing1.09Å1.10Å
CBSH4sing1.09Å1.10Å
CBRH5sing1.09Å1.10Å
CBRH6sing1.09Å1.10Å
CBRH7sing1.09Å1.10Å
CAJH8sing1.09Å1.10Å
CAJH9sing1.09Å1.10Å
C6H10sing1.08Å1.08Å
NAVH11sing0.97Å1.00Å
CAXH12sing1.09Å1.10Å
CAXH13sing1.09Å1.10Å
CAWH15sing1.09Å1.10Å
CAWH16sing1.09Å1.10Å
CBLH17sing1.08Å1.08Å
CBHH18sing1.08Å1.08Å
CBIH19sing1.08Å1.08Å
CBJH20sing1.08Å1.08Å
NBMH21sing0.97Å1.00Å
CBOH22sing1.08Å1.08Å
CBPH24sing1.08Å1.08Å
CBPH25sing1.08Å1.08Å
CAXCAYsing1.53Å29.32Å
CAYCAZsing1.53Å0.00Å
CAZC7sing1.53Å0.00Å
C7N2sing1.47Å0.00Å
N2C9sing1.47Å0.00Å
N2C8sing1.47Å0.00Å
C8C10sing1.53Å0.00Å
C9C11sing1.53Å0.00Å
CAYH14sing1.09Å0.00Å
CAYH23sing1.09Å0.00Å
CAZH26sing1.09Å0.00Å
CAZH27sing1.09Å0.00Å
C7H28sing1.09Å0.00Å
C7H29sing1.09Å0.00Å
C9H30sing1.09Å0.00Å
C9H31sing1.09Å0.00Å
C8H32sing1.09Å0.00Å
C8H33sing1.09Å0.00Å
C10H34sing1.09Å0.00Å
C10H35sing1.09Å0.00Å
C10H36sing1.09Å0.00Å
C11H37sing1.09Å0.00Å
C11H38sing1.09Å0.00Å
C11H39sing1.09Å0.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CBROASCAP110.7°117.0°
OASCBRH5109.5°109.5°
OASCBRH6109.5°109.5°
OASCBRH7109.5°109.4°
OASCAPCAO124.4°120.0°
OASCAPCAQ114.5°119.9°
CAOCAPCAQ121.1°120.0°
CAPCAOCAN117.4°120.1°
CAPCAOH1121.3°119.9°
CAPCAQCLR120.8°120.0°
CAPCAQCAL121.5°119.9°
CLRCAQCAL117.7°120.0°
CAOCANOAT122.9°120.0°
CAOCANCAM121.6°120.0°
CANCAOH1121.3°120.0°
CAQCALCAM119.4°120.0°
CAQCALNAI119.4°120.0°
CBJCBICBH121.3°120.0°
CBICBJCBK120.6°120.0°
CBJCBIH19119.4°120.0°
CBICBJH20119.7°120.0°
CBICBHCBG118.3°120.2°
CBICBHH18120.9°119.9°
CBHCBIH19119.4°119.9°
CBJCBKNBM120.0°120.1°
CBJCBKCBL118.1°119.9°
CBKCBJH20119.7°120.0°
OATCANCAM115.5°120.0°
CANOATCBS115.9°117.0°
CANCAMCAL118.9°120.0°
CANCAMCLU116.1°120.0°
CBHCBGCBL120.9°120.1°
CBHCBGCAW118.9°120.0°
CBGCBHH18120.8°119.9°
CAMCALNAI121.3°120.0°
CALCAMCLU125.0°120.0°
CALNAICAH119.5°120.4°
CALNAICAJ105.3°120.5°
OATCBSH2109.5°109.5°
OATCBSH3109.5°109.5°
OATCBSH4109.5°109.5°
OAKCAHNAI118.1°118.4°
OAKCAHNAG120.4°118.4°
NBMCBKCBL121.9°120.1°
CBKNBMCBN122.6°120.0°
CBKNBMH21118.7°120.0°
CBKCBLCBG120.9°119.9°
CBKCBLH17119.6°120.1°
NBMCBNCBO120.1°120.0°
NBMCBNOBQ121.1°120.0°
CBNNBMH21118.7°120.0°
CAHNAICAJ115.5°119.1°
NAICAHNAG121.5°123.2°
NAICAJC5103.0°116.6°
NAICAJH8111.1°108.0°
NAICAJH9111.0°108.0°
CAHNAGCAW117.5°118.5°
CAHNAGC4113.1°123.0°
CBLCBGCAW120.2°119.9°
CBGCBLH17119.6°120.0°
CBGCAWNAG113.7°109.4°
CBGCAWH15108.4°109.6°
CBGCAWH16108.4°109.5°
CBOCBNOBQ118.9°120.0°
CBNCBOCBP112.5°120.1°
CBNCBOH22123.8°120.0°
CBPCBOH22123.7°120.0°
CBOCBPH24120.0°120.0°
CBOCBPH25120.0°119.9°
CAJC5C4119.6°118.2°
CAJC5C6120.9°122.2°
C5CAJH8111.0°108.0°
C5CAJH9111.1°108.0°
CAWNAGC4114.3°118.4°
NAGCAWH15108.4°109.4°
NAGCAWH16108.4°109.4°
NAGC4C5117.6°119.8°
NAGC4N3123.1°121.5°
C4C5C6119.5°119.6°
C5C4N3119.2°118.6°
C5C6N1118.6°118.6°
C5C6H10120.7°120.8°
C4N3C2121.5°120.3°
C6N1C2120.0°120.8°
N1C6H10120.7°120.7°
N3C2N1121.1°122.1°
N3C2NAV120.6°119.0°
N1C2NAV118.3°119.0°
C2NAVCAX121.2°120.0°
C2NAVH11106.5°120.0°
CAXNAVH11106.4°120.0°
NAVCAXH12116.6°109.5°
NAVCAXH13116.6°109.5°
NAVCAXCAY78.2°109.5°
H2CBSH3109.5°109.4°
H2CBSH4109.5°109.4°
H3CBSH4109.4°109.5°
H5CBRH6109.4°109.4°
H5CBRH7109.4°109.5°
H6CBRH7109.5°109.5°
H8CAJH9109.5°107.8°
H12CAXH13109.5°109.5°
H12CAXCAY116.6°109.5°
H13CAXCAY116.6°109.4°
H15CAWH16109.5°109.5°
H24CBPH25120.0°120.1°
CAXCAYCAZ90.0°109.5°
CAXCAYH1490.0°109.5°
CAXCAYH2390.0°109.4°
CAYCAZC790.0°109.5°
CAZCAYH1490.0°109.5°
CAZCAYH2390.0°109.5°
CAYCAZH2690.0°109.5°
CAYCAZH2790.0°109.5°
CAZC7N290.0°109.5°
C7CAZH2690.0°109.5°
C7CAZH2790.0°109.5°
CAZC7H2890.0°109.5°
CAZC7H2990.0°109.5°
C7N2C990.0°111.0°
C7N2C890.0°111.0°
N2C7H2890.0°109.5°
N2C7H2990.0°109.5°
C9N2C890.0°111.0°
N2C9C1190.0°109.4°
N2C9H3090.0°109.5°
N2C9H3190.0°109.5°
N2C8C1090.0°109.5°
N2C8H3290.0°109.5°
N2C8H3390.0°109.5°
C10C8H3290.0°109.5°
C10C8H3390.0°109.5°
C8C10H3490.0°109.5°
C8C10H3590.0°109.5°
C8C10H3690.0°109.5°
C11C9H3090.0°109.5°
C11C9H3190.0°109.5°
C9C11H3790.0°109.5°
C9C11H3890.0°109.5°
C9C11H3990.0°109.5°
H14CAYH2390.0°109.5°
H26CAZH2790.0°109.5°
H28C7H2990.0°109.5°
H30C9H3190.0°109.5°
H32C8H3390.0°109.4°
H34C10H3590.0°109.5°
H34C10H3690.0°109.4°
H35C10H3690.0°109.5°
H37C11H3890.0°109.5°
H37C11H3990.0°109.4°
H38C11H3990.0°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CBROASCAPCAO46.7°0.0°
CBROASCAPCAQ134.4°180.0°
OASCBRH5H6120.0°120.0°
OASCBRH5H7120.0°120.0°
OASCBRH6H7120.0°120.0°
OASCAPCAOCAQ178.9°180.0°
OASCAPCAQCLR0.6°0.0°
OASCAPCAOCAN179.9°180.0°
OASCAPCAQCAL179.6°179.7°
OASCAPCAOH10.1°0.3°
CAPOASCBRH5180.0°60.0°
CAPOASCBRH660.0°60.0°
CAPOASCBRH760.0°180.0°
CAOCAPCAQCLR179.5°180.0°
CAPCAOCANH1180.0°179.7°
CAOCAPCAQCAL0.6°0.3°
CAPCAOCANOAT179.4°179.8°
CAPCAOCANCAM1.0°0.3°
CAPCAQCLRCAL179.9°179.7°
CAQCAPCAOCAN1.1°0.0°
CAPCAQCALCAM0.0°0.2°
CAPCAQCALNAI179.9°179.7°
CAQCAPCAOH1178.9°179.7°
CLRCAQCALCAM179.9°180.0°
CLRCAQCALNAI0.0°0.0°
CAOCANOATCAM179.6°179.9°
CAOCANCAMCAL0.5°0.3°
CAOCANOATCBS29.8°0.1°
CAOCANCAMCLU179.7°180.0°
CAQCALCAMCAN0.0°0.0°
CAQCALCAMNAI179.9°180.0°
CAQCALCAMCLU179.8°179.8°
CAQCALNAICAH112.2°90.0°
CAQCALNAICAJ116.0°89.7°
CBJCBICBHH19180.0°179.8°
CBICBJCBKH20180.0°179.8°
CBJCBICBHCBG0.1°0.0°
CBICBJCBKNBM178.7°180.0°
CBICBJCBKCBL0.3°0.5°
CBJCBICBHH18179.9°179.9°
CBHCBICBJCBK0.0°0.2°
CBICBHCBGH18180.0°179.9°
CBICBHCBGCBL0.4°0.0°
CBICBHCBGCAW179.6°179.7°
CBHCBICBJH20180.0°180.0°
CBJCBKNBMCBL178.3°179.4°
CBJCBKNBMCBN89.4°34.0°
CBJCBKCBLCBG0.6°0.6°
CBJCBKCBLH17179.4°179.5°
CBKCBJCBIH19180.0°180.0°
CBJCBKNBMH2190.6°146.1°
OATCANCAMCAL179.9°179.8°
OATCANCAMCLU0.1°0.1°
OATCANCAOH10.6°0.1°
CANOATCBSH2180.0°180.0°
CANOATCBSH360.0°60.0°
CANOATCBSH460.0°60.1°
CANCAMCALCLU179.8°179.7°
CANCAMCALNAI179.9°180.0°
CAMCANOATCBS150.7°180.0°
CAMCANCAOH1179.0°180.0°
CBHCBGCBLCBK0.7°0.3°
CBHCBGCBLCAW179.1°179.6°
CBHCBGCAWNAG27.7°90.3°
CBHCBGCAWH15148.4°149.7°
CBHCBGCAWH1692.9°29.6°
CBHCBGCBLH17179.3°179.7°
CBGCBHCBIH19179.9°179.8°
CAMCALNAICAH67.9°90.1°
CAMCALNAICAJ63.9°90.3°
CALNAICAHOAK26.2°0.0°
NAICALCAMCLU0.1°0.3°
CALNAICAHCAJ127.3°179.7°
CALNAICAHNAG151.4°179.7°
CALNAICAJC5172.8°180.0°
CALNAICAJH868.2°58.2°
CALNAICAJH953.8°58.2°
OATCBSH2H3120.0°120.1°
OATCBSH2H4120.0°120.0°
OATCBSH3H4120.0°120.0°
OAKCAHNAINAG177.7°179.7°
OAKCAHNAICAJ153.5°179.7°
OAKCAHNAGCAW22.1°0.3°
OAKCAHNAGC4158.7°179.7°
CBKNBMCBNH21180.0°179.9°
NBMCBKCBLCBG179.0°180.0°
CBKNBMCBNCBO179.9°175.0°
CBKNBMCBNOBQ0.3°5.0°
NBMCBKCBLH171.0°0.0°
NBMCBKCBJH201.3°0.3°
CBLCBKNBMCBN92.3°146.5°
CBKCBLCBGH17180.0°180.0°
CBKCBLCBGCAW179.8°180.0°
CBLCBKCBJH20179.7°179.7°
CBLCBKNBMH2187.7°33.4°
NBMCBNCBOOBQ179.6°180.0°
NBMCBNCBOCBP161.7°179.9°
NBMCBNCBOH2218.3°0.0°
CAHNAICAJC553.1°0.3°
NAICAHNAGCAW160.2°180.0°
NAICAHNAGC423.7°0.6°
CAHNAICAJH865.8°122.1°
CAHNAICAJH9172.1°121.5°
CAJNAICAHNAG24.2°0.6°
NAICAJC5H8119.0°121.8°
NAICAJC5H9119.0°121.8°
NAICAJC5C440.3°0.0°
NAICAJC5C6138.7°180.0°
NAICAJH8H9123.0°116.5°
CAHNAGCAWCBG68.5°90.0°
CAHNAGCAWC4136.1°179.4°
CAHNAGC4C536.8°0.3°
CAHNAGC4N3147.1°179.7°
CAHNAGCAWH15170.8°150.0°
CAHNAGCAWH1652.1°30.0°
CBLCBGCAWNAG153.1°90.1°
CBLCBGCAWH1532.5°29.9°
CBLCBGCAWH1686.3°150.0°
CBLCBGCBHH18179.6°180.0°
CBGCAWNAGH15120.6°120.1°
CBGCAWNAGH16120.6°120.0°
CBGCAWNAGC467.5°90.6°
CBGCAWH15H16118.1°120.1°
CAWCBGCBLH170.2°0.1°
CAWCBGCBHH180.5°0.4°
CBNCBOCBPH22180.0°179.9°
CBOCBNNBMH210.1°5.1°
CBNCBOCBPH24180.0°180.0°
CBNCBOCBPH250.0°0.1°
OBQCBNCBOCBP17.9°0.0°
OBQCBNNBMH21179.7°174.9°
OBQCBNCBOH22162.1°180.0°
CBOCBPH24H25180.0°179.9°
CAJC5C4NAG2.4°0.0°
CAJC5C4C6179.1°180.0°
CAJC5C4N3178.7°180.0°
CAJC5C6N1179.9°180.0°
C5CAJH8H9123.0°116.5°
CAJC5C6H100.1°0.1°
CAWNAGC4C5174.9°179.7°
CAWNAGC4N39.1°0.3°
NAGCAWH15H16118.1°119.9°
NAGC4C5N3176.2°180.0°
NAGC4C5C6178.5°179.9°
NAGC4N3C2178.3°180.0°
C4NAGCAWH1553.1°29.5°
C4NAGCAWH16171.8°149.5°
C4C5C6N11.0°0.0°
C5C4N3C22.3°0.0°
C4C5CAJH878.7°121.8°
C4C5CAJH9159.3°121.8°
C4C5C6H10179.0°179.9°
C6C5C4N32.2°0.0°
C5C6N1H10180.0°179.9°
C5C6N1C20.2°0.0°
C6C5CAJH8102.3°58.2°
C6C5CAJH919.8°58.1°
C4N3C2N11.0°0.0°
C4N3C2NAV178.4°180.0°
C6N1C2N30.2°0.0°
C6N1C2NAV179.7°180.0°
N3C2N1NAV179.4°180.0°
N3C2NAVCAX5.2°180.0°
N3C2NAVH11116.4°0.1°
N1C2NAVCAX174.3°0.0°
C2N1C6H10179.8°179.9°
N1C2NAVH1164.1°179.9°
C2NAVCAXH11121.6°179.9°
C2NAVCAXH12110.2°60.1°
C2NAVCAXH13117.8°60.0°
C2NAVCAXCAY3.8°179.9°
NAVCAXH12H13135.1°120.0°
NAVCAXH12CAY89.8°120.0°
NAVCAXH13CAY89.8°120.0°
NAVCAXCAYCAZ90.0°180.0°
NAVCAXCAYH1490.0°60.0°
NAVCAXCAYH2390.0°60.0°
H2CBSH3H4120.0°119.9°
H5CBRH6H7119.9°120.1°
H11NAVCAXH1211.4°120.1°
H11NAVCAXH13120.5°119.9°
H11NAVCAXCAY125.4°0.0°
H12CAXH13CAY135.1°120.0°
H12CAXCAYCAZ90.0°60.0°
H12CAXCAYH1490.0°180.0°
H12CAXCAYH2390.0°60.0°
H13CAXCAYCAZ90.0°60.1°
H13CAXCAYH1490.0°60.0°
H13CAXCAYH2390.0°180.0°
H18CBHCBIH190.1°0.3°
H19CBICBJH200.1°0.2°
H22CBOCBPH240.0°0.1°
H22CBOCBPH25180.0°180.0°
CAXCAYCAZH1490.0°120.1°
CAXCAYCAZH2390.0°119.9°
CAXCAYCAZC790.0°179.9°
CAXCAYH14H2390.0°119.9°
CAXCAYCAZH2690.0°60.0°
CAXCAYCAZH2790.0°60.0°
CAYCAZC7H2690.0°120.0°
CAYCAZC7H2790.0°120.0°
CAYCAZC7N290.0°180.0°
CAZCAYH14H2390.0°120.0°
CAYCAZH26H2790.0°120.0°
CAYCAZC7H2890.0°60.0°
CAYCAZC7H2990.0°60.0°
CAZC7N2H2890.0°120.0°
CAZC7N2H2990.0°120.0°
CAZC7N2C990.0°170.0°
CAZC7N2C890.0°66.1°
C7CAZCAYH1490.0°60.0°
C7CAZCAYH2390.0°60.0°
C7CAZH26H2790.0°120.0°
CAZC7H28H2990.0°120.0°
C7N2C9C890.0°123.9°
C7N2C8C1090.0°166.9°
C7N2C9C1190.0°72.5°
N2C7CAZH2690.0°60.0°
N2C7CAZH2790.0°60.0°
N2C7H28H2990.0°120.0°
C7N2C9H3090.0°47.5°
C7N2C9H3190.0°167.5°
C7N2C8H3290.0°73.0°
C7N2C8H3390.0°46.9°
C9N2C8C1090.0°69.2°
N2C9C11H3090.0°120.0°
N2C9C11H3190.0°120.0°
C9N2C7H2890.0°50.0°
C9N2C7H2990.0°70.0°
N2C9H30H3190.0°120.0°
C9N2C8H3290.0°50.9°
C9N2C8H3390.0°170.8°
N2C9C11H3790.0°53.6°
N2C9C11H3890.0°66.4°
N2C9C11H3990.0°173.6°
N2C8C10H3290.0°120.0°
N2C8C10H3390.0°120.0°
C8N2C9C1190.0°163.6°
C8N2C7H2890.0°174.0°
C8N2C7H2990.0°54.0°
C8N2C9H3090.0°76.4°
C8N2C9H3190.0°43.6°
N2C8H32H3390.0°120.0°
N2C8C10H3490.0°173.9°
N2C8C10H3590.0°53.9°
N2C8C10H3690.0°66.1°
C10C8H32H3390.0°120.0°
C8C10H34H3590.0°120.0°
C8C10H34H3690.0°120.0°
C8C10H35H3690.0°120.0°
C11C9H30H3190.0°120.0°
C9C11H37H3890.0°120.0°
C9C11H37H3990.0°120.0°
C9C11H38H3990.0°120.0°
H14CAYCAZH2690.0°180.0°
H14CAYCAZH2790.0°60.0°
H23CAYCAZH2690.0°59.9°
H23CAYCAZH2790.0°179.9°
H26CAZC7H2890.0°180.0°
H26CAZC7H2990.0°60.0°
H27CAZC7H2890.0°60.0°
H27CAZC7H2990.0°180.0°
H30C9C11H3790.0°173.6°
H30C9C11H3890.0°53.6°
H30C9C11H3990.0°66.4°
H31C9C11H3790.0°66.4°
H31C9C11H3890.0°173.5°
H31C9C11H3990.0°53.5°
H32C8C10H3490.0°66.0°
H32C8C10H3590.0°174.0°
H32C8C10H3690.0°54.0°
H33C8C10H3490.0°54.0°
H33C8C10H3590.0°66.1°
H33C8C10H3690.0°173.9°
H34C10H35H3690.0°119.9°
H37C11H38H3990.0°120.0°

222624

PDB entries from 2024-07-17

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