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JFK

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
NBICsing1.33Å1.35Å
COdoub1.21Å1.23Å
CCAsing1.50Å1.41Å
SBKNsing1.66Å1.71Å
NCBGsing1.46Å1.49Å
NCAsing1.47Å1.49Å
CACBsing1.53Å1.52Å
CAHAsing1.09Å1.10Å
CBCAMsing1.52Å1.52Å
CBHBsing1.09Å1.10Å
CBHBAsing1.09Å1.10Å
OAUCAAsing1.43Å1.43Å
CAAHAAsing1.09Å1.10Å
CAAHAAAsing1.09Å1.10Å
CAAHAABsing1.09Å1.10Å
CABOAVsing1.43Å1.43Å
CABHABsing1.09Å1.10Å
CABHABAsing1.09Å1.10Å
CABHABBsing1.09Å1.10Å
OADCBDdoub1.22Å1.23Å
SBKOAEdoub1.42Å1.50Å
SBKOAFdoub1.42Å1.51Å
CAZCAGdoub1.39Å1.39ÅAromatic
CAGCAHsing1.38Å1.40ÅAromatic
CAGHAGsing1.08Å1.08Å
CBBCAHdoub1.39Å1.39ÅAromatic
CAHHAHsing1.08Å1.08Å
CAJCAIdoub1.37Å1.38ÅAromatic
CAICBAsing1.38Å1.37ÅAromatic
CAIHAIsing1.08Å1.08Å
CBECAJsing1.40Å1.33ÅAromatic
CAJHAJsing1.08Å1.08Å
CAKCAZsing1.39Å1.39ÅAromatic
CAKCBCdoub1.38Å1.38ÅAromatic
CAKHAKsing1.08Å1.08Å
CBFCALsing1.38Å1.34ÅAromatic
CALCBAdoub1.38Å1.39ÅAromatic
CALHALsing1.08Å1.08Å
CAOCAMsing1.52Å1.52Å
CAMHAMsing1.09Å1.10Å
CAMHAMAsing1.09Å1.10Å
CANOAWsing1.43Å1.41Å
CANCARsing1.53Å1.53Å
CANHANsing1.09Å1.10Å
CANHANAsing1.09Å1.10Å
CBGCAOsing1.52Å1.53Å
CAOHAOsing1.09Å1.10Å
CAOHAOAsing1.09Å1.10Å
CASCAQsing1.54Å1.53Å
CAQCBGsing1.53Å1.54Å
CAQHAQsing1.09Å1.10Å
CAQHAQAsing1.09Å1.10Å
CARNBIsing1.46Å1.50Å
CARHARsing1.09Å1.10Å
CARHARAsing1.09Å1.10Å
CASNBIsing1.46Å1.46Å
CASHASsing1.09Å1.10Å
CASHASAsing1.09Å1.10Å
CBDNATsing1.34Å1.33Å
NATCBEsing1.38Å1.35Å
NATHNATsing0.97Å1.00Å
CBBOAUsing1.36Å1.37Å
OAVCBCsing1.36Å1.36Å
OAWCAZsing1.36Å1.37Å
CBDSAXsing1.77Å1.56Å
SAXCBFsing1.77Å1.63Å
CBASBKsing1.76Å1.75Å
CBCCBBsing1.39Å1.38ÅAromatic
CBECBFdoub1.40Å1.35ÅAromatic
CBGHBGsing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
NBICO116.3°118.0°
NBICCA126.5°123.9°
CNBICAR116.3°116.9°
CNBICAS123.9°126.3°
OCCA117.1°118.1°
CCAN109.9°109.8°
CCACB109.5°109.1°
CCAHA109.1°109.6°
SBKNCBG113.7°121.2°
SBKNCA115.1°121.2°
NSBKOAE108.9°106.4°
NSBKOAF110.3°106.4°
NSBKCBA106.4°107.2°
CBGNCA115.7°117.6°
NCBGCAO114.1°110.7°
NCBGCAQ108.0°109.3°
NCBGHBG108.2°108.8°
NCACB112.6°109.1°
NCAHA108.0°109.5°
CBCAHA107.6°109.7°
CACBCAM108.7°110.2°
CACBHB109.6°109.3°
CACBHBA109.6°109.3°
CAMCBHB109.7°109.4°
CAMCBHBA109.7°109.4°
CBCAMCAO109.9°110.9°
CBCAMHAM109.4°109.1°
CBCAMHAMA109.4°109.2°
HBCBHBA109.5°109.2°
OAUCAAHAA109.5°109.4°
OAUCAAHAAA109.5°109.5°
OAUCAAHAAB109.5°109.5°
CAAOAUCBB112.8°117.0°
HAACAAHAAA109.5°109.5°
HAACAAHAAB109.5°109.4°
HAAACAAHAAB109.5°109.5°
OAVCABHAB109.5°109.4°
OAVCABHABA109.5°109.5°
OAVCABHABB109.5°109.4°
CABOAVCBC111.9°117.0°
HABCABHABA109.5°109.5°
HABCABHABB109.5°109.5°
HABACABHABB109.4°109.5°
OADCBDNAT125.6°126.9°
OADCBDSAX124.4°127.0°
OAESBKOAF114.8°123.1°
OAESBKCBA109.8°106.4°
OAFSBKCBA106.2°106.4°
CAZCAGCAH119.9°120.1°
CAZCAGHAG120.0°119.9°
CAGCAZCAK119.1°120.0°
CAGCAZOAW123.1°120.0°
CAHCAGHAG120.0°120.0°
CAGCAHCBB120.3°120.0°
CAGCAHHAH119.9°120.0°
CBBCAHHAH119.9°120.0°
CAHCBBOAU124.8°120.0°
CAHCBBCBC119.5°120.0°
CAJCAICBA121.3°120.9°
CAJCAIHAI119.4°119.6°
CAICAJCBE120.1°120.7°
CAICAJHAJ119.9°119.6°
CBACAIHAI119.4°119.5°
CAICBACAL117.1°119.4°
CAICBASBK117.4°120.3°
CBECAJHAJ120.0°119.7°
CAJCBENAT126.9°128.0°
CAJCBECBF119.3°117.6°
CAZCAKCBC120.9°120.0°
CAZCAKHAK119.6°120.0°
CAKCAZOAW117.8°120.0°
CBCCAKHAK119.6°120.0°
CAKCBCOAV123.1°120.0°
CAKCBCCBB120.3°119.9°
CBFCALCBA120.0°119.9°
CBFCALHAL120.0°120.1°
CALCBFSAX131.8°132.4°
CALCBFCBE122.3°121.5°
CBACALHAL120.0°120.0°
CALCBASBK125.6°120.3°
CAOCAMHAM109.4°109.3°
CAOCAMHAMA109.4°109.2°
CAMCAOCBG109.5°111.0°
CAMCAOHAO109.5°109.2°
CAMCAOHAOA109.5°109.2°
HAMCAMHAMA109.5°109.2°
OAWCANCAR107.4°109.5°
OAWCANHAN110.0°109.4°
OAWCANHANA110.0°109.5°
CANOAWCAZ118.9°117.0°
CARCANHAN110.0°109.5°
CARCANHANA110.0°109.5°
CANCARNBI115.4°109.5°
CANCARHAR108.0°109.4°
CANCARHARA108.0°109.5°
HANCANHANA109.4°109.5°
CBGCAOHAO109.5°109.1°
CBGCAOHAOA109.5°109.1°
CAOCBGCAQ110.9°110.9°
CAOCBGHBG107.8°108.2°
HAOCAOHAOA109.5°109.1°
CASCAQCBG107.3°108.3°
CASCAQHAQ110.0°109.7°
CASCAQHAQA110.0°109.9°
CAQCASNBI108.5°111.1°
CAQCASHAS109.7°109.1°
CAQCASHASA109.7°109.1°
CBGCAQHAQ110.0°109.6°
CBGCAQHAQA110.0°109.7°
CAQCBGHBG107.6°108.9°
HAQCAQHAQA109.4°109.7°
NBICARHAR108.0°109.5°
NBICARHARA108.0°109.5°
CARNBICAS119.8°116.8°
HARCARHARA109.4°109.5°
NBICASHAS109.7°109.1°
NBICASHASA109.7°109.3°
HASCASHASA109.5°109.1°
CBDNATCBE112.6°118.7°
CBDNATHNAT123.7°120.7°
NATCBDSAX109.9°106.1°
CBENATHNAT123.7°120.7°
NATCBECBF113.8°114.4°
OAUCBBCBC115.7°120.0°
OAVCBCCBB116.5°120.0°
CBDSAXCBF97.8°94.7°
SAXCBFCBE105.9°106.1°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
NBICOCA179.6°179.8°
NBICCAN4.3°29.5°
NBICCACB119.9°90.0°
NBICCAHA122.6°149.9°
CNBICARCAN115.1°90.0°
CNBICASCAQ66.7°56.0°
CNBICARCAS178.8°180.0°
CNBICARHAR124.0°150.0°
CNBICARHARA5.8°30.0°
CNBICASHAS173.5°176.3°
CNBICASHASA53.2°64.5°
OCCAN175.3°150.2°
OCCACB60.5°90.2°
OCCAHA57.0°29.9°
OCNBICAR2.9°11.7°
OCNBICAS178.4°168.3°
CCANSBK147.3°91.6°
CCANCBG76.8°88.4°
CCANCB122.4°119.6°
CCANHA118.9°120.3°
CCACBHA118.4°120.1°
CCACBCAM67.4°151.3°
CCACBHB52.5°31.1°
CCACBHBA172.7°88.4°
CACNBICAR177.5°168.5°
CACNBICAS1.2°11.5°
SBKNCBGCA136.4°179.9°
SBKNCACB90.3°148.8°
SBKNCAHA28.4°28.7°
NSBKOAEOAF124.2°122.9°
NSBKOAECBA116.2°114.1°
NSBKOAFCBA115.0°114.1°
NSBKCBACAI91.7°90.0°
NSBKCBACAL88.6°90.1°
SBKNCBGCAO93.7°117.8°
SBKNCBGCAQ142.5°119.8°
SBKNCBGHBG26.3°1.0°
CBGNCACB45.6°31.1°
CBGNCAHA164.3°151.2°
CBGNSBKOAE158.5°156.5°
CBGNSBKOAF31.6°23.6°
NCBGCAOCAM49.3°23.7°
NCBGCAOCAQ122.2°121.5°
NCBGCAOHBG120.2°119.2°
NCBGCAOHAO169.3°144.1°
NCBGCAOHAOA70.7°96.7°
NCBGCAQCAS10.4°33.0°
NCBGCAQHBG116.6°118.7°
NCBGCAQHAQ130.1°152.6°
NCBGCAQHAQA109.3°86.9°
CBGNSBKCBA83.2°90.0°
NCACBHA118.9°120.0°
NCACBCAM55.2°31.4°
NCACBHB175.1°88.9°
NCACBHBA64.7°151.6°
CANSBKOAE21.7°23.6°
CANSBKOAF105.1°156.5°
CANCBGCAO42.8°62.1°
CANCBGCAQ81.1°60.3°
CANSBKCBA140.1°90.0°
CANCBGHBG162.8°179.1°
CACBCAMHB119.9°120.2°
CACBCAMHBA119.9°120.2°
CACBHBHBA120.3°119.6°
CACBCAMCAO63.7°66.3°
CACBCAMHAM56.4°173.3°
CACBCAMHAMA176.2°54.0°
HACACBCAM174.2°88.6°
HACACBHB65.9°151.2°
HACACBHBA54.3°31.7°
CAMCBHBHBA120.4°119.7°
CBCAMCAOHAM120.1°120.3°
CBCAMCAOHAMA120.1°120.3°
CBCAMHAMHAMA119.8°119.3°
CBCAMCAOCBG60.5°35.4°
CBCAMCAOHAO179.5°84.9°
CBCAMCAOHAOA59.5°155.8°
HBCBCAMCAO176.4°53.9°
HBCBCAMHAM63.5°66.5°
HBCBCAMHAMA56.3°174.2°
HBACBCAMCAO56.1°173.4°
HBACBCAMHAM176.2°53.0°
HBACBCAMHAMA63.9°66.3°
OAUCAAHAAHAAA120.0°120.0°
OAUCAAHAAHAAB120.0°120.0°
OAUCAAHAAAHAAB120.0°120.1°
CAAOAUCBBCAH6.8°0.0°
CAAOAUCBBCBC173.5°180.0°
HAACAAHAAAHAAB120.0°119.9°
HAACAAOAUCBB180.0°180.0°
HAAACAAOAUCBB60.0°60.0°
HAABCAAOAUCBB60.0°60.0°
OAVCABHABHABA120.0°119.9°
OAVCABHABHABB120.0°120.0°
OAVCABHABAHABB120.0°120.0°
CABOAVCBCCAK2.6°0.1°
CABOAVCBCCBB177.3°179.2°
HABCABHABAHABB120.0°120.1°
HABCABOAVCBC180.0°60.0°
HABACABOAVCBC60.0°59.9°
HABBCABOAVCBC60.0°180.0°
OADCBDNATSAX179.8°180.0°
OADCBDNATCBE179.8°180.0°
OADCBDNATHNAT0.2°0.0°
OADCBDSAXCBF179.9°180.0°
OAESBKOAFCBA121.6°123.0°
OAESBKCBACAI150.6°23.5°
OAESBKCBACAL29.1°156.4°
OAFSBKCBACAI25.9°156.4°
OAFSBKCBACAL153.8°23.5°
CAZCAGCAHHAG180.0°179.8°
CAZCAGCAHCBB0.4°0.2°
CAZCAGCAHHAH179.6°179.8°
CAGCAZCAKOAW179.6°180.0°
CAGCAZCAKCBC0.1°0.6°
CAGCAZCAKHAK179.8°180.0°
CAGCAZOAWCAN9.9°0.0°
CAGCAHCBBHAH180.0°180.0°
CAHCAGCAZCAK0.1°0.1°
CAGCAHCBBOAU179.9°180.0°
CAHCAGCAZOAW179.7°180.0°
CAGCAHCBBCBC0.4°0.0°
HAGCAGCAHCBB179.6°180.0°
HAGCAGCAHHAH0.4°0.0°
HAGCAGCAZCAK179.9°179.7°
HAGCAGCAZOAW0.3°0.2°
CAHCBBCBCCAK0.2°0.5°
CAHCBBOAUCBC179.6°180.0°
CAHCBBCBCOAV179.7°179.7°
HAHCAHCBBOAU0.1°0.0°
HAHCAHCBBCBC179.5°180.0°
CAJCAICBAHAI180.0°179.8°
CAICAJCBEHAJ180.0°180.0°
CAJCAICBACAL0.4°0.2°
CAICAJCBENAT179.6°180.0°
CAJCAICBASBK179.8°179.7°
CAICAJCBECBF0.2°0.0°
CBACAICAJCBE0.5°0.0°
CBACAICAJHAJ179.5°180.0°
CAICBACALCBF0.1°0.5°
CAICBACALSBK179.7°179.9°
CAICBACALHAL179.9°180.0°
HAICAICAJCBE179.5°179.7°
HAICAICAJHAJ0.4°0.3°
HAICAICBACAL179.6°180.0°
HAICAICBASBK0.2°0.1°
CAJCBECBFCAL0.2°0.3°
CAJCBENATCBD180.0°180.0°
CAJCBENATCBF179.7°179.9°
CAJCBENATHNAT0.0°0.0°
CAJCBECBFSAX180.0°180.0°
HAJCAJCBENAT0.4°0.0°
HAJCAJCBECBF179.8°180.0°
CAZCAKCBCHAK180.0°179.5°
CAKCAZOAWCAN170.5°180.0°
CAZCAKCBCOAV180.0°180.0°
CAZCAKCBCCBB0.1°0.8°
CAKCBCCBBOAU179.8°179.5°
CAKCBCOAVCBB179.9°179.2°
CBCCAKCAZOAW179.4°179.5°
HAKCAKCBCOAV0.0°0.6°
HAKCAKCAZOAW0.6°0.0°
HAKCAKCBCCBB179.9°179.7°
CBFCALCBAHAL180.0°179.5°
CALCBFCBENAT179.9°179.7°
CALCBFSAXCBD180.0°179.7°
CALCBFSAXCBE179.8°179.6°
CBFCALCBASBK179.9°179.4°
CBACALCBFSAX179.9°179.9°
CBACALCBFCBE0.2°0.5°
HALCALCBFSAX0.1°0.4°
HALCALCBASBK0.1°0.0°
HALCALCBFCBE179.8°180.0°
CAOCAMHAMHAMA119.8°119.3°
CAMCAOCBGHAO120.0°120.4°
CAMCAOCBGHAOA120.0°120.4°
CAMCAOHAOHAOA120.0°119.3°
CAMCAOCBGCAQ72.9°97.7°
CAMCAOCBGHBG169.5°142.9°
HAMCAMCAOCBG59.6°155.7°
HAMCAMCAOHAO60.4°35.4°
HAMCAMCAOHAOA179.6°83.9°
HAMACAMCAOCBG179.5°84.9°
HAMACAMCAOHAO59.5°154.7°
HAMACAMCAOHAOA60.5°35.5°
OAWCANCARHAN119.7°119.9°
OAWCANCARHANA119.7°120.0°
OAWCANHANHANA121.0°120.0°
OAWCANCARNBI70.2°65.0°
OAWCANCARHAR168.9°175.0°
OAWCANCARHARA50.7°55.0°
CARCANHANHANA120.9°120.1°
CANCARNBIHAR120.9°119.9°
CANCARNBIHARA120.9°120.0°
CANCARHARHARA117.3°120.0°
CANCARNBICAS66.1°90.0°
CARCANOAWCAZ81.3°180.0°
HANCANCARNBI49.5°175.0°
HANCANCARHAR71.4°55.1°
HANCANCARHARA170.4°65.0°
HANCANOAWCAZ159.1°60.0°
HANACANCARNBI170.1°55.0°
HANACANCARHAR49.2°65.0°
HANACANCARHARA69.0°175.0°
HANACANOAWCAZ38.4°60.0°
CBGCAOHAOHAOA120.0°119.2°
CAOCBGCAQCAS136.1°155.3°
CAOCBGCAQHBG117.7°118.9°
CAOCBGCAQHAQ104.2°85.0°
CAOCBGCAQHAQA16.4°35.4°
HAOCAOCBGCAQ47.0°22.6°
HAOCAOCBGHBG70.5°96.7°
HAOACAOCBGCAQ167.0°141.8°
HAOACAOCBGHBG49.5°22.5°
CASCAQCBGHAQ119.7°119.6°
CASCAQCBGHAQA119.7°119.9°
CASCAQHAQHAQA121.0°120.7°
CAQCASNBICAR112.0°124.0°
CAQCASNBIHAS119.8°120.3°
CAQCASNBIHASA119.9°120.4°
CAQCASHASHASA120.4°119.1°
CASCAQCBGHBG106.2°85.7°
CBGCAQHAQHAQA121.0°120.5°
CBGCAQCASNBI83.1°89.0°
CBGCAQCASHAS157.1°150.7°
CBGCAQCASHASA36.8°31.6°
HAQCAQCASNBI157.2°151.4°
HAQCAQCASHAS37.4°31.2°
HAQCAQCASHASA82.9°88.0°
HAQCAQCBGHBG13.5°33.9°
HAQACAQCASNBI36.6°30.8°
HAQACAQCASHAS83.3°89.5°
HAQACAQCASHASA156.5°151.4°
HAQACAQCBGHBG134.1°154.4°
NBICARHARHARA117.3°120.0°
CARNBICASHAS7.9°3.7°
CARNBICASHASA128.2°115.5°
HARCARNBICAS54.7°30.0°
HARACARNBICAS173.0°150.0°
NBICASHASHASA120.5°119.4°
CBDNATCBEHNAT180.0°179.9°
NATCBDSAXCBF0.1°0.0°
CBDNATCBECBF0.2°0.1°
CBENATCBDSAX0.0°0.0°
NATCBECBFSAX0.3°0.1°
HNATNATCBDSAX180.0°180.0°
HNATNATCBECBF179.8°180.0°
OAUCBBCBCOAV0.1°0.3°
CBDSAXCBFCBE0.2°0.0°

226262

PDB entries from 2024-10-16

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