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2K2

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CALCARsing1.39Å1.39ÅAromatic
CALCAJdoub1.38Å1.38ÅAromatic
CACCBQsing1.53Å1.53Å
CARCBFdoub1.34Å1.34ÅAromatic
CAJCAPsing1.39Å1.39ÅAromatic
CBFCBDsing1.34Å1.34ÅAromatic
CBFNBOsing1.34Å1.34ÅAromatic
CAPCBDdoub1.34Å1.34ÅAromatic
CBQOAWsing1.43Å1.43Å
CBQNBOsing1.50Å1.50Å
CBQCBPsing1.55Å1.55Å
OAWCBKsing1.44Å1.44Å
CBDCBGsing1.35Å1.35ÅAromatic
NBOCBJsing1.35Å1.35ÅAromatic
OAECAYdoub1.24Å1.24Å
CBPCBLsing1.50Å1.50Å
CBPOAVsing1.45Å1.45Å
CBGCBJsing1.33Å1.33ÅAromatic
CBGCBAdoub1.35Å1.35ÅAromatic
CBJCBIdoub1.35Å1.35ÅAromatic
CBLNBMsing1.47Å1.47Å
CBLCATsing1.52Å1.52Å
CBKNBNsing1.49Å1.49Å
CBKCATsing1.52Å1.52Å
CAYNBMsing1.36Å1.36Å
CAYCAZsing1.39Å1.39Å
CAMCAZdoub1.39Å1.39ÅAromatic
CAMCAGsing1.39Å1.39ÅAromatic
CBACASsing1.40Å1.40Å
CBACBBsing1.36Å1.36ÅAromatic
NBMCABsing1.48Å1.48Å
CBINBNsing1.33Å1.33ÅAromatic
CBICBHsing1.36Å1.36ÅAromatic
CASNAUsing1.46Å1.46Å
NBNCBEsing1.33Å1.33ÅAromatic
OAVCAAsing1.42Å1.42Å
CAZCANsing1.40Å1.40ÅAromatic
CAGCAFdoub1.40Å1.40ÅAromatic
CBBCBHdoub1.36Å1.36ÅAromatic
CBBCAXsing1.37Å1.37Å
CBHCBCsing1.35Å1.35ÅAromatic
NAUCAXsing1.32Å1.32Å
CBECBCsing1.35Å1.35ÅAromatic
CBECAQdoub1.35Å1.35ÅAromatic
CAXOADdoub1.23Å1.23Å
CBCCAOdoub1.34Å1.34ÅAromatic
CANCAHdoub1.39Å1.39ÅAromatic
CAQCAKsing1.39Å1.39ÅAromatic
CAFCAHsing1.39Å1.39ÅAromatic
CAOCAIsing1.40Å1.40ÅAromatic
CAKCAIdoub1.38Å1.38ÅAromatic
CASH1sing1.10Å1.10Å
CAOH2sing1.08Å1.08Å
CAIH3sing1.08Å1.08Å
CAKH4sing1.08Å1.08Å
CAQH5sing1.08Å1.08Å
CAPH6sing1.08Å1.08Å
CAJH7sing1.08Å1.08Å
CALH8sing1.08Å1.08Å
CARH9sing1.08Å1.08Å
CBPH10sing1.10Å1.10Å
CAAH11sing1.10Å1.10Å
CAAH12sing1.10Å1.10Å
CAAH13sing1.10Å1.10Å
CACH14sing1.10Å1.10Å
CACH15sing1.10Å1.10Å
CACH16sing1.10Å1.10Å
CBKH17sing1.10Å1.10Å
CATH18sing1.10Å1.10Å
CATH19sing1.10Å1.10Å
CABH20sing1.10Å1.10Å
CABH21sing1.10Å1.10Å
CABH22sing1.10Å1.10Å
CAMH23sing1.08Å1.08Å
CAGH24sing1.08Å1.08Å
CAFH25sing1.08Å1.08Å
CAHH26sing1.08Å1.08Å
CANH27sing1.08Å1.08Å
CBLH28sing1.10Å1.10Å
NAUH29sing1.00Å1.00Å
CASH30sing1.10Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CARCALCAJ118.5°118.5°
CALCARCBF121.1°121.1°
CARCALH8120.8°120.8°
CALCARH9119.4°119.5°
CALCAJCAP117.9°117.9°
CALCAJH7121.0°121.0°
CAJCALH8120.7°120.7°
CACCBQOAW104.5°104.5°
CACCBQNBO115.4°115.4°
CACCBQCBP108.5°108.5°
CBQCACH14109.5°109.5°
CBQCACH15109.5°109.5°
CBQCACH16109.4°109.4°
CARCBFCBD120.7°120.7°
CARCBFNBO132.0°132.0°
CBFCARH9119.4°119.4°
CAJCAPCBD121.8°121.8°
CAJCAPH6119.1°119.1°
CAPCAJH7121.1°121.1°
CBDCBFNBO107.3°107.3°
CBFCBDCAP120.0°120.0°
CBFCBDCBG108.8°108.8°
CBFNBOCBQ127.3°127.3°
CBFNBOCBJ108.1°108.1°
CAPCBDCBG131.2°131.2°
CBDCAPH6119.1°119.1°
OAWCBQNBO106.8°106.8°
OAWCBQCBP111.5°111.5°
CBQOAWCBK119.4°119.4°
NBOCBQCBP110.0°110.0°
CBQNBOCBJ124.6°124.6°
CBQCBPCBL106.1°106.1°
CBQCBPOAV110.2°110.2°
CBQCBPH10109.5°109.5°
OAWCBKNBN106.0°106.0°
OAWCBKCAT113.7°113.7°
OAWCBKH17106.4°106.4°
CBDCBGCBJ107.2°107.2°
CBDCBGCBA133.1°133.1°
NBOCBJCBG108.5°108.5°
NBOCBJCBI132.1°132.1°
OAECAYNBM122.5°122.5°
OAECAYCAZ117.8°117.8°
CBLCBPOAV109.9°109.9°
CBPCBLNBM115.3°115.3°
CBPCBLCAT107.4°107.4°
CBLCBPH10110.1°110.1°
CBPCBLH28108.6°108.6°
CBPOAVCAA116.1°116.1°
OAVCBPH10110.9°110.9°
CBJCBGCBA119.7°119.7°
CBGCBJCBI119.4°119.4°
CBGCBACAS129.5°129.5°
CBGCBACBB122.0°122.0°
CBJCBINBN129.6°129.6°
CBJCBICBH121.6°121.6°
NBMCBLCAT107.9°107.9°
CBLNBMCAY118.6°118.6°
CBLNBMCAB119.9°119.9°
NBMCBLH28109.0°109.0°
CBLCATCBK108.6°108.6°
CBLCATH18109.7°109.7°
CBLCATH19109.7°109.7°
CATCBLH28108.4°108.4°
NBNCBKCAT118.5°118.5°
CBKNBNCBI129.2°129.2°
CBKNBNCBE122.0°122.0°
NBNCBKH17105.8°105.8°
CATCBKH17105.5°105.5°
CBKCATH18109.7°109.7°
CBKCATH19109.7°109.7°
NBMCAYCAZ119.5°119.5°
CAYNBMCAB121.4°121.4°
CAYCAZCAM121.3°121.3°
CAYCAZCAN118.4°118.4°
CAZCAMCAG119.3°119.3°
CAMCAZCAN120.2°120.2°
CAZCAMH23120.4°120.4°
CAMCAGCAF120.6°120.6°
CAGCAMH23120.4°120.4°
CAMCAGH24119.7°119.7°
CASCBACBB108.6°108.6°
CBACASNAU105.9°105.9°
CBACASH1110.3°110.4°
CBACASH30110.3°110.3°
CBACBBCBH118.1°118.1°
CBACBBCAX107.4°107.4°
NBMCABH20109.5°109.5°
NBMCABH21109.4°109.4°
NBMCABH22109.5°109.5°
NBNCBICBH108.8°108.8°
CBINBNCBE108.6°108.6°
CBICBHCBB119.2°119.2°
CBICBHCBC106.3°106.3°
CASNAUCAX105.6°105.6°
NAUCASH1110.4°110.3°
CASNAUH29127.2°127.2°
NAUCASH30110.4°110.4°
NBNCBECBC107.6°107.6°
NBNCBECAQ130.1°130.1°
OAVCAAH11109.5°109.5°
OAVCAAH12109.4°109.4°
OAVCAAH13109.4°109.4°
CAZCANCAH120.5°120.5°
CAZCANH27119.7°119.7°
CAGCAFCAH120.2°120.2°
CAFCAGH24119.7°119.7°
CAGCAFH25119.9°119.9°
CBHCBBCAX134.5°134.5°
CBBCBHCBC134.5°134.5°
CBBCAXNAU112.6°112.6°
CBBCAXOAD127.3°127.3°
CBHCBCCBE108.7°108.7°
CBHCBCCAO132.9°132.9°
NAUCAXOAD120.1°120.1°
CAXNAUH29127.2°127.2°
CBCCBECAQ122.2°122.2°
CBECBCCAO118.4°118.4°
CBECAQCAK120.8°120.8°
CBECAQH5119.6°119.6°
CBCCAOCAI121.7°121.7°
CBCCAOH2119.2°119.2°
CANCAHCAF119.2°119.2°
CANCAHH26120.4°120.4°
CAHCANH27119.8°119.8°
CAQCAKCAI117.6°117.6°
CAQCAKH4121.2°121.2°
CAKCAQH5119.6°119.6°
CAHCAFH25119.9°119.9°
CAFCAHH26120.4°120.4°
CAOCAICAK119.4°119.4°
CAICAOH2119.2°119.2°
CAOCAIH3120.3°120.3°
CAKCAIH3120.3°120.3°
CAICAKH4121.2°121.2°
H1CASH30109.5°109.5°
H11CAAH12109.5°109.5°
H11CAAH13109.5°109.5°
H12CAAH13109.5°109.5°
H14CACH15109.5°109.5°
H14CACH16109.4°109.4°
H15CACH16109.5°109.5°
H18CATH19109.5°109.5°
H20CABH21109.5°109.5°
H20CABH22109.5°109.5°
H21CABH22109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CARCALCAJH8180.0°180.0°
CALCARCBFH9180.0°180.0°
CARCALCAJCAP0.4°0.4°
CALCARCBFCBD1.1°1.1°
CALCARCBFNBO179.1°179.1°
CARCALCAJH7179.5°179.5°
CAJCALCARCBF1.4°1.4°
CALCAJCAPH7180.0°180.0°
CALCAJCAPCBD0.8°0.8°
CALCAJCAPH6179.2°179.2°
CAJCALCARH9178.5°178.6°
CACCBQNBOCBF32.8°32.8°
CACCBQOAWNBO122.8°122.8°
CACCBQOAWCBP117.0°117.0°
CACCBQNBOCBP123.2°123.2°
CACCBQOAWCBK148.6°148.6°
CACCBQNBOCBJ149.6°149.6°
CACCBQCBPCBL86.5°86.5°
CACCBQCBPOAV154.6°154.6°
CACCBQCBPH1032.3°32.3°
CBQCACH14H15120.0°120.0°
CBQCACH14H16120.0°120.0°
CBQCACH15H16120.0°120.0°
CARCBFCBDNBO179.8°179.8°
CARCBFCBDCAP0.1°0.1°
CARCBFNBOCBQ1.4°1.4°
CARCBFCBDCBG180.0°180.0°
CARCBFNBOCBJ179.3°179.3°
CBFCARCALH8178.6°178.6°
CAJCAPCBDCBF1.1°1.1°
CAJCAPCBDH6180.0°180.0°
CAJCAPCBDCBG179.0°179.0°
CAPCAJCALH8179.6°179.6°
CBFCBDCAPCBG179.8°179.8°
CBDCBFNBOCBQ178.8°178.8°
CBDCBFNBOCBJ0.9°0.9°
CBFCBDCBGCBJ0.6°0.6°
CBFCBDCBGCBA179.5°179.5°
CBFCBDCAPH6178.9°178.9°
CBDCBFCARH9178.8°178.9°
NBOCBFCBDCAP179.7°179.7°
CBFNBOCBQOAW148.5°148.5°
CBFNBOCBQCBJ177.6°177.6°
CBFNBOCBQCBP90.3°90.3°
NBOCBFCBDCBG0.2°0.2°
CBFNBOCBJCBG1.3°1.3°
CBFNBOCBJCBI179.6°179.6°
NBOCBFCARH90.9°0.9°
CAPCBDCBGCBJ179.6°179.6°
CAPCBDCBGCBA0.6°0.6°
CBDCAPCAJH7179.2°179.2°
OAWCBQNBOCBP121.2°121.2°
OAWCBQNBOCBJ34.0°34.0°
OAWCBQCBPCBL28.0°28.0°
OAWCBQCBPOAV90.9°90.9°
CBQOAWCBKNBN83.4°83.4°
CBQOAWCBKCAT48.5°48.5°
OAWCBQCBPH10146.9°146.9°
OAWCBQCACH14180.0°180.0°
OAWCBQCACH1560.0°60.0°
OAWCBQCACH1660.0°60.0°
CBQOAWCBKH17164.2°164.2°
NBOCBQOAWCBK88.6°88.6°
NBOCBQCBPCBL146.4°146.4°
NBOCBQCBPOAV27.4°27.4°
CBQNBOCBJCBG179.3°179.3°
CBQNBOCBJCBI1.6°1.6°
NBOCBQCBPH1094.8°94.8°
NBOCBQCACH1463.1°63.1°
NBOCBQCACH1557.0°57.0°
NBOCBQCACH16177.0°177.0°
CBPCBQOAWCBK31.6°31.6°
CBPCBQNBOCBJ87.2°87.2°
CBQCBPCBLOAV119.1°119.1°
CBQCBPCBLH10118.4°118.4°
CBQCBPOAVH10121.4°121.4°
CBQCBPCBLNBM167.0°167.0°
CBQCBPCBLCAT72.7°72.7°
CBQCBPOAVCAA97.3°97.3°
CBPCBQCACH1460.9°60.9°
CBPCBQCACH15179.0°179.0°
CBPCBQCACH1659.0°59.0°
CBQCBPCBLH2844.3°44.3°
OAWCBKCATCBL1.6°1.6°
OAWCBKNBNCAT129.2°129.2°
OAWCBKNBNH17112.8°112.8°
OAWCBKCATH17116.2°116.2°
OAWCBKNBNCBI25.6°25.6°
OAWCBKNBNCBE148.9°148.9°
OAWCBKCATH18121.5°121.5°
OAWCBKCATH19118.3°118.3°
CBDCBGCBJNBO1.2°1.2°
CBDCBGCBJCBA179.1°179.1°
CBDCBGCBJCBI179.6°179.6°
CBDCBGCBACAS0.9°0.9°
CBDCBGCBACBB179.1°179.1°
CBGCBDCAPH60.9°0.9°
NBOCBJCBGCBI179.2°179.2°
NBOCBJCBGCBA179.8°179.8°
NBOCBJCBINBN1.7°1.7°
NBOCBJCBICBH179.6°179.6°
OAECAYNBMCBL1.5°1.5°
OAECAYNBMCAZ174.6°174.6°
OAECAYCAZCAM72.1°72.1°
OAECAYNBMCAB178.0°178.0°
OAECAYCAZCAN104.3°104.3°
CBLCBPOAVH10122.0°122.0°
CBPCBLNBMCAT120.0°120.0°
CBPCBLNBMH28122.5°122.5°
CBPCBLCATH28117.2°117.2°
CBPCBLCATCBK56.7°56.7°
CBPCBLNBMCAY136.9°136.9°
CBPCBLNBMCAB46.6°46.6°
CBLCBPOAVCAA146.2°146.2°
CBPCBLCATH1863.1°63.1°
CBPCBLCATH19176.6°176.6°
OAVCBPCBLNBM73.9°73.9°
OAVCBPCBLCAT46.4°46.4°
CBPOAVCAAH11180.0°180.0°
CBPOAVCAAH1260.0°60.0°
CBPOAVCAAH1360.0°60.0°
OAVCBPCBLH28163.4°163.4°
CBJCBGCBACAS179.7°179.7°
CBJCBGCBACBB0.3°0.3°
CBGCBJCBINBN179.3°179.3°
CBGCBJCBICBH0.5°0.5°
CBACBGCBJCBI0.5°0.5°
CBGCBACASCBB180.0°180.0°
CBGCBACASNAU178.9°178.9°
CBGCBACBBCBH0.1°0.1°
CBGCBACBBCAX179.8°179.8°
CBGCBACASH159.4°59.5°
CBGCBACASH3061.7°61.7°
CBJCBINBNCBK4.6°4.6°
CBJCBINBNCBH178.9°178.9°
CBJCBINBNCBE179.7°179.7°
CBJCBICBHCBB0.3°0.3°
CBJCBICBHCBC179.8°179.8°
NBMCBLCATH28117.9°117.9°
NBMCBLCATCBK178.4°178.4°
CBLNBMCAYCAB176.4°176.4°
CBLNBMCAYCAZ173.1°173.1°
NBMCBLCBPH1048.6°48.6°
NBMCBLCATH1861.7°61.7°
NBMCBLCATH1958.6°58.6°
CBLNBMCABH20180.0°180.0°
CBLNBMCABH2160.0°60.0°
CBLNBMCABH2260.0°60.0°
CBLCATCBKNBN124.0°124.0°
CBLCATCBKH18119.9°119.9°
CBLCATCBKH19119.9°119.9°
CATCBLNBMCAY103.0°103.0°
CATCBLNBMCAB73.4°73.4°
CATCBLCBPH10168.8°168.8°
CBLCATCBKH17117.8°117.8°
CBLCATH18H19120.4°120.4°
NBNCBKCATH17118.2°118.2°
CBKNBNCBICBE175.1°175.1°
CBKNBNCBICBH176.5°176.5°
CBKNBNCBECBC177.0°177.0°
CBKNBNCBECAQ4.1°4.1°
NBNCBKCATH184.1°4.1°
NBNCBKCATH19116.2°116.2°
CATCBKNBNCBI103.5°103.5°
CATCBKNBNCBE81.9°81.9°
CBKCATH18H19120.4°120.4°
CBKCATCBLH2860.5°60.5°
NBMCAYCAZCAM113.0°113.0°
NBMCAYCAZCAN70.6°70.6°
CAYNBMCABH203.6°3.6°
CAYNBMCABH21116.4°116.4°
CAYNBMCABH22123.6°123.7°
CAYNBMCBLH2814.5°14.5°
CAYCAZCAMCAN176.3°176.3°
CAYCAZCAMCAG178.0°178.0°
CAZCAYNBMCAB3.3°3.3°
CAYCAZCANCAH178.7°178.7°
CAYCAZCAMH232.0°2.0°
CAYCAZCANH271.3°1.3°
CAZCAMCAGH23180.0°180.0°
CAZCAMCAGCAF0.4°0.4°
CAMCAZCANCAH2.3°2.3°
CAZCAMCAGH24179.6°179.6°
CAMCAZCANH27177.7°177.7°
CAGCAMCAZCAN1.7°1.7°
CAMCAGCAFH24180.0°180.0°
CAMCAGCAFCAH0.3°0.3°
CAMCAGCAFH25179.7°179.7°
CBACASNAUH1119.4°119.5°
CBACASNAUH30119.4°119.4°
CASCBACBBCBH179.9°179.9°
CASCBACBBCAX0.2°0.2°
CBACASNAUCAX1.6°1.6°
CBACASH1H30121.6°121.7°
CBACASNAUH29178.4°178.4°
CBACBBCBHCBI0.1°0.1°
CBBCBACASNAU1.1°1.1°
CBACBBCBHCAX179.8°179.8°
CBACBBCBHCBC180.0°180.0°
CBACBBCAXNAU0.9°0.9°
CBACBBCAXOAD178.2°178.2°
CBBCBACASH1120.6°120.5°
CBBCBACASH30118.3°118.3°
NBMCABH20H21120.0°120.0°
NBMCABH20H22120.0°120.0°
NBMCABH21H22120.0°120.0°
CABNBMCBLH28169.1°169.1°
NBNCBICBHCBB179.3°179.3°
NBNCBICBHCBC0.8°0.8°
CBINBNCBECBC1.4°1.4°
CBINBNCBECAQ179.6°179.6°
CBINBNCBKH17138.4°138.4°
CBHCBINBNCBE1.4°1.4°
CBICBHCBBCBC179.9°179.9°
CBICBHCBBCAX179.7°179.7°
CBICBHCBCCBE0.1°0.1°
CBICBHCBCCAO179.7°179.7°
CASNAUCAXCBB1.6°1.6°
CASNAUCAXH29180.0°180.0°
CASNAUCAXOAD179.1°179.1°
NAUCASH1H30121.7°121.6°
NBNCBECBCCBH1.0°1.0°
NBNCBECBCCAQ179.1°179.1°
NBNCBECBCCAO179.4°179.4°
NBNCBECAQCAK178.9°178.9°
NBNCBECAQH51.1°1.1°
CBENBNCBKH1736.1°36.1°
CAAOAVCBPH1024.1°24.1°
OAVCAAH11H12120.0°120.0°
OAVCAAH11H13120.0°120.0°
OAVCAAH12H13119.9°120.0°
CAZCANCAHH27180.0°180.0°
CAZCANCAHCAF1.5°1.5°
CANCAZCAMH23178.3°178.3°
CAZCANCAHH26178.5°178.5°
CAGCAFCAHCAN0.2°0.2°
CAGCAFCAHH25180.0°180.0°
CAFCAGCAMH23179.5°179.5°
CAGCAFCAHH26179.8°179.8°
CBHCBBCAXNAU178.9°178.9°
CBBCBHCBCCBE179.8°179.8°
CBHCBBCAXOAD1.6°1.6°
CBBCBHCBCCAO0.2°0.2°
CAXCBBCBHCBC0.2°0.2°
CBBCAXNAUOAD177.5°177.5°
CBBCAXNAUH29178.4°178.4°
CBHCBCCBECAO179.6°179.6°
CBHCBCCBECAQ179.9°179.9°
CBHCBCCAOCAI179.8°179.8°
CBHCBCCAOH20.2°0.2°
CAXNAUCASH1121.0°121.1°
CAXNAUCASH30117.8°117.8°
CBCCBECAQCAK0.0°0.0°
CBECBCCAOCAI0.3°0.3°
CBECBCCAOH2179.8°179.8°
CBCCBECAQH5180.0°180.0°
CAQCBECBCCAO0.3°0.3°
CBECAQCAKH5180.0°180.0°
CBECAQCAKCAI0.2°0.2°
CBECAQCAKH4179.7°179.7°
OADCAXNAUH290.9°0.9°
CBCCAOCAIH2180.0°180.0°
CBCCAOCAICAK0.0°0.0°
CBCCAOCAIH3180.0°180.0°
CANCAHCAFH26180.0°180.0°
CANCAHCAFH25179.8°179.8°
CAQCAKCAICAO0.3°0.3°
CAQCAKCAIH4180.0°180.0°
CAQCAKCAIH3179.8°179.8°
CAHCAFCAGH24179.7°179.7°
CAFCAHCANH27178.5°178.5°
CAOCAICAKH3180.0°180.0°
CAOCAICAKH4179.7°179.7°
CAKCAICAOH2180.0°180.0°
CAICAKCAQH5179.8°179.8°
H1CASNAUH2959.0°58.9°
H2CAOCAIH30.0°0.0°
H3CAICAKH40.3°0.3°
H4CAKCAQH50.3°0.3°
H6CAPCAJH70.8°0.8°
H7CAJCALH80.4°0.4°
H8CALCARH91.4°1.4°
H10CBPCBLH2874.1°74.1°
H11CAAH12H13120.0°120.0°
H14CACH15H16120.0°120.0°
H17CBKCATH18122.3°122.3°
H17CBKCATH192.1°2.1°
H18CATCBLH28179.6°179.6°
H19CATCBLH2859.3°59.3°
H20CABH21H22120.0°120.0°
H23CAMCAGH240.5°0.5°
H24CAGCAFH250.3°0.3°
H25CAFCAHH260.2°0.2°
H26CAHCANH271.5°1.5°
H29NAUCASH3062.2°62.2°

222624

PDB entries from 2024-07-17

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