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C84

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CAQOAFsing1.43Å1.43Å
CAQCBNsing1.53Å1.53Å
CBNOAXsing1.43Å1.45Å
CBNCBLsing1.53Å1.54Å
OAXCBHsing1.43Å1.43Å
OAHCBHsing1.43Å1.43Å
CBHCBOsing1.53Å1.54Å
OAKCBLsing1.43Å1.45Å
CBLCBMsing1.53Å1.53Å
CBMCBOsing1.53Å1.60Å
CBMOALsing1.43Å1.44Å
CBOOBAsing1.43Å1.44Å
OBAPBSsing1.61Å1.60Å
OANPBSdoub1.48Å1.47Å
PBSOAEsing1.61Å1.48Å
PBSN6sing1.64Å1.76Å
N6C6sing1.38Å1.34Å
C6C5sing1.41Å1.35ÅAromatic
C6N1doub1.33Å1.35ÅAromatic
N7C5sing1.35Å1.33ÅAromatic
N7C8doub1.30Å1.33ÅAromatic
C5C4doub1.41Å1.34ÅAromatic
N1C2sing1.32Å1.48ÅAromatic
C8N9sing1.36Å1.34ÅAromatic
C4N9sing1.37Å1.34ÅAromatic
C4N3sing1.33Å1.35ÅAromatic
C2N3doub1.32Å1.48ÅAromatic
N9CBPsing1.46Å1.56Å
OADPBRdoub1.48Å1.49Å
OAGCBGsing1.43Å1.44Å
CBPOAYsing1.44Å1.46Å
CBPCBGsing1.54Å1.55Å
OAZPBRsing1.61Å1.65Å
OAZCBIsing1.43Å1.45Å
OAYCBIsing1.44Å1.50Å
CAACBFsing1.53Å1.54Å
PBRNAVsing1.64Å1.71Å
PBROAMsing1.61Å1.49Å
CBGCARsing1.55Å1.50Å
CARCBIsing1.55Å1.54Å
NAVCBBsing1.35Å1.35Å
OAICBJsing1.43Å1.44Å
CBFCABsing1.53Å1.55Å
CBFCBKsing1.53Å1.57Å
CBBCBJsing1.51Å1.56Å
CBBOACdoub1.21Å1.23Å
CBJCBKsing1.53Å1.56Å
CBKOAJsing1.43Å1.44Å
CBIH1sing1.09Å1.10Å
CARH2sing1.09Å1.10Å
CARH3sing1.09Å1.10Å
CBGH4sing1.09Å1.10Å
OAGH5sing0.97Å0.95Å
CBPH6sing1.09Å1.10Å
C8H7sing1.08Å1.08Å
C2H8sing1.08Å1.08Å
N6H9sing0.97Å1.00Å
CAAH10sing1.09Å1.10Å
CAAH11sing1.09Å1.10Å
CAAH12sing1.09Å1.10Å
CBFH13sing1.09Å1.10Å
CABH14sing1.09Å1.10Å
CABH15sing1.09Å1.10Å
CABH16sing1.09Å1.10Å
CBKH17sing1.09Å1.10Å
OAJH18sing0.97Å0.95Å
CBJH19sing1.09Å1.10Å
OAIH20sing0.97Å0.95Å
NAVH21sing0.97Å1.00Å
OAMH22sing0.97Å0.95Å
OAEH23sing0.97Å0.95Å
CBOH24sing1.09Å1.10Å
CBMH25sing1.09Å1.10Å
OALH26sing0.97Å0.95Å
CBLH27sing1.09Å1.10Å
OAKH28sing0.97Å0.95Å
CBNH29sing1.09Å1.10Å
CAQH30sing1.09Å1.10Å
CAQH31sing1.09Å1.10Å
OAFH32sing0.97Å0.95Å
CBHH33sing1.09Å1.10Å
OAHH34sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
OAFCAQCBN108.2°109.5°
OAFCAQH30109.8°109.5°
OAFCAQH31109.8°109.5°
CAQOAFH32109.5°114.0°
CAQCBNOAX107.5°109.5°
CAQCBNCBL112.1°109.5°
CAQCBNH29110.0°109.4°
CBNCAQH30109.8°109.5°
CBNCAQH31109.8°109.5°
OAXCBNCBL106.2°109.4°
CBNOAXCBH114.2°114.2°
OAXCBNH29111.1°109.5°
CBNCBLOAK112.4°109.6°
CBNCBLCBM109.4°109.2°
CBNCBLH27107.7°109.5°
CBLCBNH29109.8°109.5°
OAXCBHOAH97.2°109.5°
OAXCBHCBO108.3°109.4°
OAXCBHH33113.7°109.5°
OAHCBHCBO111.3°109.6°
OAHCBHH33113.6°109.5°
CBHOAHH34109.5°114.0°
CBHCBOCBM108.9°109.2°
CBHCBOOBA110.9°109.6°
CBHCBOH24109.2°109.5°
CBOCBHH33111.9°109.4°
OAKCBLCBM110.6°109.5°
OAKCBLH27108.8°109.5°
CBLOAKH28109.5°114.0°
CBLCBMCBO112.2°109.1°
CBLCBMOAL106.4°109.6°
CBLCBMH25108.8°109.6°
CBMCBLH27107.9°109.5°
CBOCBMOAL111.4°109.5°
CBMCBOOBA108.8°109.5°
CBMCBOH24108.4°109.5°
CBOCBMH25107.9°109.5°
OALCBMH25110.0°109.5°
CBMOALH26109.5°114.0°
CBOOBAPBS120.7°123.0°
OBACBOH24110.6°109.6°
OBAPBSOAN104.8°109.5°
OBAPBSOAE99.4°109.5°
OBAPBSN6106.3°109.5°
OANPBSOAE115.1°109.5°
OANPBSN6110.8°109.4°
OAEPBSN6118.3°109.5°
PBSOAEH23109.5°114.0°
PBSN6C6124.3°120.0°
PBSN6H9105.6°120.0°
N6C6C5114.8°120.7°
N6C6N1121.6°120.8°
C6N6H9105.6°120.0°
C5C6N1121.9°118.5°
C6C5N7132.3°134.7°
C6C5C4121.1°118.1°
C6N1C2122.0°121.2°
C5N7C8108.3°109.5°
N7C5C4106.3°107.1°
N7C8N9108.1°110.0°
N7C8H7126.0°125.0°
C5C4N9109.2°106.0°
C5C4N3120.6°119.1°
N1C2N3110.7°122.5°
N1C2H8124.7°118.8°
C8N9C4105.4°107.4°
C8N9CBP126.6°126.3°
N9C8H7126.0°125.0°
N9C4N3128.6°135.0°
C4N9CBP121.2°126.2°
C4N3C2123.1°120.7°
N3C2H8124.7°118.8°
N9CBPOAY111.6°109.8°
N9CBPCBG116.2°110.0°
N9CBPH6106.1°110.0°
OADPBROAZ101.1°109.5°
OADPBRNAV115.2°109.5°
OADPBROAM114.8°109.4°
OAGCBGCBP115.3°110.7°
OAGCBGCAR110.5°110.5°
OAGCBGH4109.4°110.5°
CBGOAGH5109.5°114.0°
OAYCBPCBG108.9°107.3°
CBPOAYCBI108.1°106.9°
OAYCBPH6107.3°109.8°
CBPCBGCAR105.0°104.2°
CBPCBGH4107.9°110.4°
CBGCBPH6106.2°109.9°
PBROAZCBI127.3°123.0°
OAZPBRNAV102.4°109.5°
OAZPBROAM105.5°109.5°
OAZCBIOAY108.4°110.6°
OAZCBICAR106.6°110.6°
OAZCBIH1112.5°110.6°
OAYCBICAR106.0°103.6°
OAYCBIH1111.8°110.6°
CAACBFCAB107.5°109.5°
CAACBFCBK112.5°109.4°
CBFCAAH10109.5°109.4°
CBFCAAH11109.5°109.4°
CBFCAAH12109.5°109.5°
CAACBFH13108.5°109.5°
NAVPBROAM115.3°109.5°
PBRNAVCBB120.4°120.0°
PBRNAVH21119.8°120.0°
PBROAMH22109.5°114.0°
CBGCARCBI106.4°102.1°
CBGCARH2110.2°110.9°
CBGCARH3110.2°111.0°
CARCBGH4108.5°110.5°
CARCBIH1111.1°110.6°
CBICARH2110.2°110.9°
CBICARH3110.2°110.9°
NAVCBBCBJ116.0°119.9°
NAVCBBOAC123.5°120.0°
CBBNAVH21119.8°120.0°
OAICBJCBB114.3°109.4°
OAICBJCBK111.7°109.5°
OAICBJH19106.5°109.4°
CBJOAIH20109.5°114.0°
CABCBFCBK111.8°109.5°
CABCBFH13108.4°109.5°
CBFCABH14109.5°109.5°
CBFCABH15109.5°109.5°
CBFCABH16109.4°109.5°
CBFCBKCBJ115.4°109.5°
CBFCBKOAJ111.3°109.5°
CBKCBFH13108.1°109.4°
CBFCBKH17106.5°109.4°
CBJCBBOAC120.2°120.0°
CBBCBJCBK113.1°109.5°
CBBCBJH19105.2°109.5°
CBJCBKOAJ108.6°109.5°
CBJCBKH17106.6°109.4°
CBKCBJH19105.2°109.5°
OAJCBKH17108.0°109.5°
CBKOAJH18109.5°114.0°
H2CARH3109.5°110.7°
H10CAAH11109.4°109.5°
H10CAAH12109.5°109.5°
H11CAAH12109.5°109.5°
H14CABH15109.4°109.4°
H14CABH16109.5°109.4°
H15CABH16109.5°109.5°
H30CAQH31109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
OAFCAQCBNH30119.8°120.0°
OAFCAQCBNH31119.8°120.0°
OAFCAQCBNOAX62.2°65.0°
OAFCAQCBNCBL54.1°175.0°
OAFCAQCBNH29176.6°55.1°
OAFCAQH30H31120.6°120.0°
CAQCBNOAXCBL120.1°120.1°
CAQCBNOAXH29120.5°120.0°
CAQCBNCBLH29122.6°120.0°
CAQCBNOAXCBH170.4°178.8°
CAQCBNCBLOAK60.7°62.4°
CAQCBNCBLCBM176.1°177.6°
CAQCBNCBLH2759.1°57.7°
CBNCAQH30H31120.6°120.0°
CBNCAQOAFH32180.0°180.0°
OAXCBNCBLH29120.2°120.0°
CBNOAXCBHOAH177.2°178.8°
CBNOAXCBHCBO67.5°61.0°
OAXCBNCBLOAK177.9°177.6°
OAXCBNCBLCBM58.9°57.6°
OAXCBNCBLH2758.0°62.3°
OAXCBNCAQH30177.9°175.0°
OAXCBNCAQH3157.6°55.0°
CBNOAXCBHH3357.5°58.8°
CBLCBNOAXCBH69.4°61.1°
CBNCBLOAKCBM122.5°119.7°
CBNCBLOAKH27119.2°120.1°
CBNCBLCBMH27116.9°119.9°
CBNCBLCBMCBO52.6°57.0°
CBNCBLCBMOAL174.7°176.8°
CBNCBLCBMH2566.7°62.9°
CBNCBLOAKH28180.0°60.3°
CBLCBNCAQH3065.7°55.0°
CBLCBNCAQH31173.9°64.9°
OAXCBHOAHCBO112.8°120.0°
OAXCBHOAHH33119.8°120.0°
OAXCBHCBOH33126.0°119.9°
OAXCBHCBOCBM53.4°57.5°
OAXCBHCBOOBA173.1°177.4°
OAXCBHCBOH2464.7°62.4°
CBHOAXCBNH2950.0°58.8°
OAXCBHOAHH34180.0°60.0°
OAHCBHCBOH33128.4°120.0°
OAHCBHCBOCBM159.0°177.5°
OAHCBHCBOOBA81.2°62.5°
OAHCBHCBOH2440.9°57.7°
CBHCBOCBMCBL49.5°56.9°
CBHCBOCBMOBA121.0°120.0°
CBHCBOCBMH24118.6°119.9°
CBHCBOCBMOAL168.7°176.8°
CBHCBOOBAH24121.3°120.1°
CBHCBOOBAPBS132.5°120.1°
CBHCBOCBMH2570.4°63.1°
CBOCBHOAHH3467.2°180.0°
OAKCBLCBMH27118.9°120.1°
OAKCBLCBMCBO176.9°176.9°
OAKCBLCBMOAL61.0°63.2°
OAKCBLCBMH2557.5°57.0°
OAKCBLCBNH2961.9°57.5°
CBLCBMCBOOAL119.2°119.9°
CBLCBMCBOH25119.9°120.0°
CBLCBMOALH25117.7°120.3°
CBLCBMCBOOBA170.6°176.9°
CBLCBMCBOH2469.1°63.0°
CBLCBMOALH26180.0°60.5°
CBMCBLOAKH2857.5°180.0°
CBMCBLCBNH2961.3°62.4°
CBOCBMOALH25119.7°120.1°
CBMCBOOBAH24118.9°120.1°
CBMCBOOBAPBS107.7°120.2°
CBOCBMOALH2657.4°179.9°
CBOCBMCBLH2764.2°62.9°
CBMCBOCBHH3372.6°62.5°
OALCBMCBOOBA70.2°63.2°
OALCBMCBOH2450.1°56.9°
OALCBMCBLH2757.8°56.9°
CBOOBAPBSOAN38.1°44.9°
CBOOBAPBSOAE157.4°165.0°
CBOOBAPBSN679.3°75.0°
OBACBOCBMH2550.7°56.9°
OBACBOCBHH3347.1°57.5°
OBAPBSOANOAE108.1°120.0°
OBAPBSOANN6114.3°120.0°
OBAPBSOAEN6114.3°120.0°
OBAPBSN6C6141.9°60.0°
OBAPBSN6H996.0°120.0°
OBAPBSOAEH23111.3°59.9°
PBSOBACBOH2411.2°0.1°
OANPBSOAEN6134.3°120.0°
OANPBSN6C6104.7°180.0°
OANPBSN6H917.3°0.0°
OANPBSOAEH230.0°180.0°
OAEPBSN6C631.4°60.0°
OAEPBSN6H9153.4°120.0°
PBSN6C6H9122.0°180.0°
PBSN6C6C5179.8°180.0°
PBSN6C6N114.2°0.1°
N6PBSOAEH23134.3°60.0°
N6C6C5N1165.5°179.9°
N6C6C5N75.4°0.0°
N6C6C5C4167.4°179.8°
N6C6N1C2168.9°179.8°
C6C5N7C4173.6°179.8°
C6C5N7C8179.5°180.0°
C5C6N1C24.3°0.4°
C6C5C4N9169.7°179.8°
C6C5C4N32.9°0.1°
C5C6N6H957.8°0.0°
N1C6C5N7171.0°179.9°
N1C6C5C41.9°0.3°
C6N1C2N36.9°0.2°
C6N1C2H8173.1°179.8°
N1C6N6H9107.8°179.9°
C5N7C8N914.5°0.0°
N7C5C4N94.8°0.4°
N7C5C4N3171.6°180.0°
C5N7C8H7165.5°180.0°
C8N7C5C45.9°0.2°
N7C8N9H7180.0°179.9°
N7C8N9C417.0°0.2°
N7C8N9CBP168.1°179.9°
C5C4N9C813.5°0.4°
C5C4N9N3165.4°179.6°
C5C4N3C26.5°0.0°
C5C4N9CBP166.5°179.9°
N1C2N3C48.1°0.0°
N1C2N3H8180.0°180.0°
C8N9C4CBP153.1°179.7°
C8N9C4N3178.8°180.0°
C8N9CBPOAY66.9°23.6°
C8N9CBPCBG58.7°94.2°
C8N9CBPH6176.6°144.6°
N9C4N3C2170.4°179.5°
C4N9CBPOAY80.1°156.7°
C4N9CBPCBG154.3°85.4°
C4N9CBPH636.4°35.7°
C4N9C8H7163.0°179.8°
N3C4N9CBP28.1°0.3°
C4N3C2H8171.9°180.0°
N9CBPCBGOAG5.1°2.7°
N9CBPOAYCBG129.6°119.5°
N9CBPOAYH6115.8°121.1°
N9CBPCBGH6117.8°121.2°
N9CBPOAYCBI134.4°146.0°
N9CBPCBGCAR116.6°121.5°
N9CBPCBGH4127.7°119.9°
CBPN9C8H711.9°0.1°
OADPBROAZNAV119.1°120.1°
OADPBROAZOAM119.8°119.9°
OADPBROAZCBI133.3°45.1°
OADPBRNAVOAM137.3°119.9°
OADPBRNAVCBB162.2°180.0°
OADPBRNAVH2117.8°0.0°
OADPBROAMH220.0°180.0°
OAGCBGCBPOAY132.1°116.7°
OAGCBGCBPCAR121.8°118.8°
OAGCBGCBPH4122.6°122.6°
OAGCBGCARH4119.9°122.5°
OAGCBGCARCBI145.8°139.7°
OAGCBGCARH294.6°21.5°
OAGCBGCARH326.3°102.1°
OAGCBGCBPH6112.7°123.9°
OAYCBPCBGH6115.2°119.4°
CBPOAYCBIOAZ131.9°158.5°
OAYCBPCBGCAR10.4°2.1°
CBPOAYCBICAR17.8°40.0°
CBPOAYCBIH1103.5°78.6°
OAYCBPCBGH4105.3°120.7°
CBGCBPOAYCBI4.8°26.4°
CBPCBGCARH4115.2°118.6°
CBPCBGCARCBI20.9°20.8°
CBPCBGCARH2140.5°97.4°
CBPCBGCARH398.6°139.0°
CBPCBGOAGH5180.0°176.3°
PBROAZCBIOAY169.3°93.6°
OAZPBRNAVOAM114.1°120.0°
PBROAZCBICAR77.0°152.1°
OAZPBRNAVCBB89.1°60.0°
PBROAZCBIH145.1°29.3°
OAZPBRNAVH2190.9°120.0°
OAZPBROAMH22110.3°60.0°
OAZCBIOAYCAR114.2°118.6°
OAZCBIOAYH1124.6°122.9°
CBIOAZPBRNAV107.6°75.0°
CBIOAZPBROAM13.5°165.0°
OAZCBICARCBG139.6°155.5°
OAZCBICARH1123.0°122.9°
OAZCBICARH2100.8°37.3°
OAZCBICARH320.1°86.2°
OAYCBICARCBG24.3°36.9°
OAYCBICARH1121.7°118.6°
OAYCBICARH2143.8°81.3°
OAYCBICARH395.2°155.2°
CBIOAYCBPH6109.8°93.0°
CAACBFCABCBK123.9°120.0°
CAACBFCABH13117.0°120.1°
CAACBFCBKH13119.8°120.0°
CAACBFCBKCBJ60.7°65.2°
CAACBFCBKOAJ175.0°174.7°
CBFCAAH10H11120.0°119.9°
CBFCAAH10H12120.0°120.0°
CBFCAAH11H12120.0°120.0°
CAACBFCABH14180.0°55.2°
CAACBFCABH1560.0°175.2°
CAACBFCABH1660.0°64.7°
CAACBFCBKH1757.5°54.7°
PBRNAVCBBH21180.0°180.0°
PBRNAVCBBCBJ178.0°180.0°
PBRNAVCBBOAC4.5°0.0°
NAVPBROAMH22137.4°60.0°
OAMPBRNAVCBB25.0°60.0°
OAMPBRNAVH21155.0°120.0°
CBGCARCBIH2119.5°118.2°
CBGCARCBIH3119.5°118.3°
CBGCARCBIH197.4°81.6°
CBGCARH2H3121.4°123.7°
CARCBGOAGH561.2°61.5°
CARCBGCBPH6125.6°117.3°
CBICARH2H3121.4°123.6°
CBICARCBGH494.3°97.8°
NAVCBBCBJOAI35.0°175.0°
NAVCBBCBJOAC173.7°180.0°
NAVCBBCBJCBK94.2°65.0°
NAVCBBCBJH19151.5°55.1°
OAICBJCBKCBF71.4°57.4°
OAICBJCBBCBK129.3°120.0°
OAICBJCBBH19116.4°119.9°
OAICBJCBBOAC138.6°5.0°
OAICBJCBKH19115.1°120.0°
OAICBJCBKOAJ162.9°62.6°
OAICBJCBKH1746.7°177.3°
CABCBFCBKH13119.2°120.0°
CABCBFCBKCBJ178.3°174.7°
CABCBFCBKOAJ54.0°54.7°
CABCBFCAAH10180.0°60.0°
CABCBFCAAH1160.0°180.0°
CABCBFCAAH1260.0°60.0°
CBFCABH14H15120.0°120.0°
CBFCABH14H16120.0°120.0°
CBFCABH15H16120.0°120.1°
CABCBFCBKH1763.6°65.3°
CBFCBKCBJCBB59.2°177.4°
CBFCBKCBJOAJ125.7°120.0°
CBFCBKCBJH17118.1°119.9°
CBFCBKOAJH17116.6°120.0°
CBKCBFCAAH1056.5°180.0°
CBKCBFCAAH1163.4°60.0°
CBKCBFCAAH12176.5°60.0°
CBKCBFCABH1456.1°64.7°
CBKCBFCABH15176.1°55.2°
CBKCBFCABH1663.9°175.3°
CBFCBKOAJH18180.0°60.0°
CBFCBKCBJH19173.5°62.6°
CBBCBJCBKH19114.3°120.1°
CBBCBJCBKOAJ66.5°57.4°
CBBCBJCBKH17177.3°62.7°
CBBCBJOAIH20180.0°60.1°
CBJCBBNAVH212.0°0.0°
OACCBBCBJCBK92.1°115.0°
OACCBBCBJH1922.2°124.9°
OACCBBNAVH21175.5°180.0°
CBJCBKOAJH17115.3°120.0°
CBJCBKCBFH1359.1°54.8°
CBJCBKOAJH1851.9°60.0°
CBKCBJOAIH2050.0°59.9°
OAJCBKCBFH1365.2°65.3°
OAJCBKCBJH1947.8°177.4°
H1CBICARH222.2°160.2°
H1CBICARH3143.1°36.7°
H2CARCBGH425.3°144.0°
H3CARCBGH4146.2°20.5°
H4CBGOAGH558.2°61.1°
H4CBGCBPH69.9°1.3°
H10CAAH11H12120.0°120.1°
H10CAACBFH1363.0°60.0°
H11CAACBFH13177.0°60.0°
H12CAACBFH1357.0°180.0°
H13CBFCABH1462.9°175.3°
H13CBFCABH1557.0°64.7°
H13CBFCABH16177.1°55.3°
H13CBFCBKH17177.2°174.7°
H14CABH15H16120.0°120.0°
H17CBKOAJH1863.4°180.0°
H17CBKCBJH1968.4°57.3°
H19CBJOAIH2064.3°180.0°
H24CBOCBMH25171.0°177.0°
H24CBOCBHH33169.2°177.7°
H25CBMOALH2662.3°59.8°
H25CBMCBLH27176.4°177.2°
H27CBLOAKH2860.8°59.8°
H27CBLCBNH29178.2°177.7°
H29CBNCAQH3056.8°65.0°
H29CBNCAQH3163.6°175.1°
H30CAQOAFH3260.2°60.0°
H31CAQOAFH3260.2°60.0°
H33CBHOAHH3460.2°60.1°

223532

PDB entries from 2024-08-07

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