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DQD

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CAQOARsing1.44Å1.35Å
CAQOAPsing1.44Å1.33Å
OARCASsing1.36Å1.36Å
OAPCAOsing1.37Å1.39Å
CAACABsing1.53Å1.55Å
CASCAOdoub1.39Å1.41ÅAromatic
CASCATsing1.39Å1.37ÅAromatic
CAOCANsing1.39Å1.42ÅAromatic
CACCABsing1.53Å1.52Å
CACNADsing1.47Å1.32Å
CATCALdoub1.38Å1.41ÅAromatic
CAENADsing1.47Å1.45Å
CAECAFsing1.53Å1.54Å
CAINADsing1.47Å1.46Å
CAICAHsing1.53Å1.54Å
CANCAMdoub1.38Å1.40ÅAromatic
CALCAMsing1.38Å1.42ÅAromatic
CALCAKsing1.51Å1.61Å
CAGCAFsing1.53Å1.43Å
CAGCAHsing1.53Å1.44Å
CAGNAJsing1.47Å1.52Å
CAKNAJsing1.47Å1.44Å
NAJCAUsing1.35Å1.42Å
CAUOAVdoub1.22Å1.20Å
CAUNAWsing1.35Å1.37Å
NAWCAXsing1.40Å1.41Å
CAXCBCdoub1.39Å1.38ÅAromatic
CAXCAYsing1.39Å1.41ÅAromatic
CBCCBBsing1.38Å1.40ÅAromatic
CAYCAZdoub1.38Å1.41ÅAromatic
CBBCBDsing1.51Å1.51Å
CBBCBAdoub1.38Å1.39ÅAromatic
CAZCBAsing1.38Å1.40ÅAromatic
FBECBDsing1.40Å1.33Å
FBGCBDsing1.40Å1.34Å
CBDFBFsing1.40Å1.33Å
CBCH1sing1.08Å1.08Å
CBAH2sing1.08Å1.08Å
CAZH3sing1.08Å1.08Å
CAYH4sing1.08Å1.08Å
NAWH5sing0.97Å1.00Å
CAGH6sing1.09Å1.10Å
CAHH7sing1.09Å1.10Å
CAHH8sing1.09Å1.10Å
CAIH9sing1.09Å1.10Å
CAIH10sing1.09Å1.10Å
CAFH11sing1.09Å1.10Å
CAFH12sing1.09Å1.10Å
CAEH13sing1.09Å1.10Å
CAEH14sing1.09Å1.10Å
CACH16sing1.09Å1.10Å
CACH17sing1.09Å1.10Å
CABH18sing1.09Å1.10Å
CABH19sing1.09Å1.10Å
CAAH20sing1.09Å1.10Å
CAAH21sing1.09Å1.10Å
CAAH22sing1.09Å1.10Å
CAKH23sing1.09Å1.10Å
CAKH24sing1.09Å1.10Å
CATH25sing1.08Å1.08Å
CAQH26sing1.09Å1.10Å
CANH27sing1.08Å1.08Å
CAMH28sing1.08Å1.08Å
CAQH15sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
OARCAQOAP110.0°103.8°
CAQOARCAS109.1°105.5°
OARCAQH26109.4°110.6°
OARCAQH15109.4°110.6°
CAQOAPCAO107.7°105.4°
OAPCAQH26109.3°110.5°
OAPCAQH15109.3°110.6°
OARCASCAO106.2°108.7°
OARCASCAT131.9°131.5°
OAPCAOCAS107.0°108.7°
OAPCAOCAN133.1°131.5°
CAACABCAC113.7°109.5°
CAACABH18108.4°109.5°
CAACABH19108.4°109.4°
CABCAAH20109.5°109.5°
CABCAAH21109.5°109.4°
CABCAAH22109.5°109.5°
CAOCASCAT122.0°119.8°
CASCAOCAN119.8°119.8°
CASCATCAL118.6°120.1°
CASCATH25120.7°120.0°
CAOCANCAM118.6°120.1°
CAOCANH27120.7°119.9°
CABCACNAD118.4°109.5°
CABCACH16107.2°109.5°
CABCACH17107.2°109.5°
CACCABH18108.4°109.5°
CACCABH19108.4°109.5°
CACNADCAE112.4°111.0°
CACNADCAI114.0°111.0°
NADCACH16107.2°109.4°
NADCACH17107.2°109.4°
CATCALCAM120.7°120.1°
CATCALCAK116.0°119.9°
CALCATH25120.7°120.0°
NADCAECAF112.6°109.5°
CAENADCAI108.8°111.2°
NADCAEH13108.7°109.5°
NADCAEH14108.7°109.5°
CAECAFCAG109.2°109.3°
CAECAFH11109.5°109.5°
CAECAFH12109.5°109.6°
CAFCAEH13108.7°109.4°
CAFCAEH14108.7°109.5°
NADCAICAH109.4°109.5°
NADCAIH9109.5°109.5°
NADCAIH10109.5°109.5°
CAICAHCAG111.6°109.2°
CAICAHH7108.9°109.5°
CAICAHH8108.9°109.5°
CAHCAIH9109.5°109.5°
CAHCAIH10109.5°109.4°
CANCAMCAL120.3°120.1°
CAMCANH27120.7°120.0°
CANCAMH28119.8°119.9°
CAMCALCAK123.3°119.9°
CALCAMH28119.9°119.9°
CALCAKNAJ105.7°109.5°
CALCAKH23110.4°109.5°
CALCAKH24110.4°109.4°
CAFCAGCAH111.7°109.2°
CAFCAGNAJ119.4°109.5°
CAFCAGH6107.2°109.5°
CAGCAFH11109.5°109.5°
CAGCAFH12109.5°109.5°
CAHCAGNAJ104.6°109.5°
CAHCAGH6107.1°109.6°
CAGCAHH7108.9°109.5°
CAGCAHH8108.9°109.5°
CAGNAJCAK116.7°120.0°
CAGNAJCAU121.1°120.0°
NAJCAGH6106.2°109.6°
CAKNAJCAU121.8°120.0°
NAJCAKH23110.4°109.5°
NAJCAKH24110.4°109.5°
NAJCAUOAV121.5°120.0°
NAJCAUNAW115.1°119.9°
OAVCAUNAW123.4°120.0°
CAUNAWCAX123.0°119.9°
CAUNAWH5118.5°120.0°
NAWCAXCBC120.2°120.1°
NAWCAXCAY118.2°120.1°
CAXNAWH5118.5°120.0°
CBCCAXCAY121.4°119.9°
CAXCBCCBB117.8°119.9°
CAXCBCH1121.2°120.1°
CAXCAYCAZ119.6°120.0°
CAXCAYH4120.2°120.0°
CBCCBBCBD118.4°120.0°
CBCCBBCBA122.8°120.0°
CBBCBCH1121.1°120.0°
CAYCAZCBA120.1°120.0°
CAYCAZH3119.9°120.0°
CAZCAYH4120.2°120.0°
CBDCBBCBA118.7°120.0°
CBBCBDFBE111.7°109.5°
CBBCBDFBG113.2°109.5°
CBBCBDFBF113.9°109.5°
CBBCBACAZ118.3°120.2°
CBBCBAH2120.9°119.8°
CAZCBAH2120.8°119.9°
CBACAZH3120.0°120.0°
FBECBDFBG104.4°109.5°
FBECBDFBF107.2°109.4°
FBGCBDFBF105.7°109.5°
H7CAHH8109.4°109.6°
H9CAIH10109.5°109.4°
H11CAFH12109.5°109.5°
H13CAEH14109.5°109.4°
H16CACH17109.5°109.5°
H18CABH19109.5°109.4°
H20CAAH21109.5°109.4°
H20CAAH22109.4°109.5°
H21CAAH22109.5°109.5°
H23CAKH24109.5°109.5°
H26CAQH15109.5°110.6°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
OARCAQOAPH26120.1°118.5°
OARCAQOAPH15120.1°118.6°
OARCAQOAPCAO0.6°27.1°
CAQOARCASCAO0.0°17.3°
CAQOARCASCAT179.0°162.7°
OARCAQH26H15119.8°122.9°
OAPCAQOARCAS0.4°27.1°
CAQOAPCAOCAS0.5°17.3°
CAQOAPCAOCAN179.5°162.8°
OAPCAQH26H15119.7°122.8°
OARCASCAOOAP0.3°0.0°
OARCASCAOCAT179.2°180.0°
OARCASCAOCAN179.7°180.0°
OARCASCATCAL179.8°180.0°
OARCASCATH250.2°0.0°
CASOARCAQH26119.7°145.6°
CASOARCAQH15120.5°91.5°
OAPCAOCASCAN180.0°179.9°
OAPCAOCASCAT179.4°180.0°
OAPCAOCANCAM179.3°180.0°
CAOOAPCAQH26119.5°145.7°
OAPCAOCANH270.7°0.0°
CAOOAPCAQH15120.7°91.5°
CAACABCACH18120.6°120.0°
CAACABCACH19120.6°120.0°
CAACABCACNAD178.3°180.0°
CAACABCACH1657.1°60.0°
CAACABCACH1760.4°60.1°
CAACABH18H19118.1°120.0°
CABCAAH20H21120.0°119.9°
CABCAAH20H22120.0°120.1°
CABCAAH21H22120.0°120.0°
CAOCASCATCAL1.3°0.0°
CASCAOCANCAM0.7°0.1°
CAOCASCATH25178.7°180.0°
CASCAOCANH27179.3°180.0°
CATCASCAOCAN0.5°0.1°
CASCATCALH25180.0°180.0°
CASCATCALCAM0.8°0.0°
CASCATCALCAK178.6°179.7°
CAOCANCAMH27180.0°179.9°
CAOCANCAMCAL1.1°0.1°
CAOCANCAMH28178.9°179.7°
CABCACNADH16121.3°120.0°
CABCACNADH17121.3°120.0°
CABCACNADCAE171.3°65.8°
CABCACNADCAI64.3°170.0°
CABCACH16H17115.9°120.1°
CACCABH18H19118.1°120.0°
CACCABCAAH20180.0°59.9°
CACCABCAAH2160.0°60.0°
CACCABCAAH2260.0°180.0°
CACNADCAECAI127.2°124.1°
CACNADCAECAF174.0°174.2°
CACNADCAICAH176.3°174.2°
CACNADCAIH963.7°54.2°
CACNADCAIH1056.3°65.8°
CACNADCAEH1353.5°65.8°
CACNADCAEH1465.6°54.1°
NADCACH16H17116.0°120.0°
NADCACCABH1861.1°60.0°
NADCACCABH1957.7°60.0°
CATCALCAMCAN0.4°0.0°
CATCALCAMCAK179.5°179.7°
CATCALCAKNAJ128.0°89.7°
CATCALCAKH23112.6°150.2°
CATCALCAKH248.6°30.3°
CATCALCAMH28179.6°179.7°
NADCAECAFH13120.5°120.0°
NADCAECAFH14120.5°120.1°
CAENADCAICAH57.4°61.7°
NADCAECAFCAG57.3°59.2°
CAENADCAIH962.5°178.2°
CAENADCAIH10177.4°58.3°
NADCAECAFH1162.6°179.1°
NADCAECAFH12177.3°60.8°
NADCAEH13H14118.6°120.0°
CAENADCACH1650.1°174.2°
CAENADCACH1767.4°54.2°
CAFCAENADCAI58.8°61.7°
CAECAFCAGH11120.0°119.9°
CAECAFCAGH12120.0°120.0°
CAECAFCAGCAH55.3°57.7°
CAECAFCAGNAJ177.6°177.5°
CAECAFCAGH661.7°62.3°
CAECAFH11H12120.1°120.2°
CAFCAEH13H14118.6°120.0°
NADCAICAHH9120.0°120.0°
NADCAICAHH10120.0°120.1°
NADCAICAHCAG57.7°59.2°
NADCAICAHH7178.0°60.7°
NADCAICAHH862.7°179.1°
NADCAIH9H10120.0°120.0°
CAINADCAEH13179.3°58.3°
CAINADCAEH1461.6°178.2°
CAINADCACH16174.4°50.0°
CAINADCACH1756.9°70.0°
CAICAHCAGCAF57.2°57.7°
CAICAHCAGH7120.3°119.9°
CAICAHCAGH8120.3°119.9°
CAICAHCAGNAJ172.3°177.5°
CAICAHCAGH659.9°62.3°
CAICAHH7H8119.0°120.1°
CAHCAIH9H10120.0°119.9°
CANCAMCALH28180.0°179.8°
CANCAMCALCAK179.8°179.8°
CAMCALCAKNAJ52.5°90.0°
CAMCALCAKH2366.9°30.0°
CAMCALCAKH24171.9°150.0°
CAMCALCATH25179.2°180.0°
CALCAMCANH27178.9°180.0°
CALCAKNAJCAG61.7°90.0°
CALCAKNAJH23119.4°120.0°
CALCAKNAJH24119.4°120.0°
CALCAKNAJCAU124.4°89.9°
CALCAKH23H24121.8°119.9°
CAKCALCATH251.3°0.3°
CAKCALCAMH280.2°0.0°
CAFCAGCAHNAJ130.5°119.9°
CAFCAGCAHH6117.1°119.9°
CAFCAGNAJH6121.2°120.2°
CAFCAGNAJCAK128.9°120.0°
CAFCAGNAJCAU57.1°59.9°
CAFCAGCAHH7177.5°62.2°
CAFCAGCAHH863.2°177.6°
CAGCAFH11H12120.1°120.0°
CAGCAFCAEH13177.8°60.8°
CAGCAFCAEH1463.2°179.2°
CAHCAGNAJH6113.1°120.2°
CAHCAGNAJCAK105.3°120.3°
CAHCAGNAJCAU68.6°59.7°
CAGCAHH7H8119.0°120.1°
CAGCAHCAIH962.3°179.2°
CAGCAHCAIH10177.6°60.9°
CAHCAGCAFH1164.7°177.6°
CAHCAGCAFH12175.2°62.3°
CAGNAJCAKCAU173.9°179.9°
CAGNAJCAUOAV11.0°0.1°
CAGNAJCAUNAW169.0°180.0°
NAJCAGCAHH752.0°57.7°
NAJCAGCAHH867.3°62.5°
NAJCAGCAFH1157.7°62.5°
NAJCAGCAFH1262.4°57.5°
CAGNAJCAKH23178.9°30.0°
CAGNAJCAKH2457.7°150.0°
CAKNAJCAUOAV175.4°180.0°
CAKNAJCAUNAW4.6°0.1°
CAKNAJCAGH67.8°0.2°
NAJCAKH23H24121.7°120.0°
NAJCAUOAVNAW180.0°179.9°
NAJCAUNAWCAX172.0°174.7°
NAJCAUNAWH58.0°5.2°
CAUNAJCAGH6178.3°179.9°
CAUNAJCAKH235.0°150.0°
CAUNAJCAKH24116.2°30.0°
OAVCAUNAWCAX8.0°5.4°
OAVCAUNAWH5172.0°174.7°
CAUNAWCAXH5180.0°179.9°
CAUNAWCAXCBC40.5°33.3°
CAUNAWCAXCAY144.6°146.7°
NAWCAXCBCCAY174.7°180.0°
NAWCAXCBCCBB175.9°179.9°
NAWCAXCAYCAZ175.7°179.8°
NAWCAXCBCH14.1°0.0°
NAWCAXCAYH44.3°0.0°
CAXCBCCBBH1180.0°180.0°
CBCCAXCAYCAZ0.9°0.2°
CAXCBCCBBCBD179.0°180.0°
CAXCBCCBBCBA1.4°0.3°
CBCCAXCAYH4179.1°180.0°
CBCCAXNAWH5139.4°146.7°
CAYCAXCBCCBB1.2°0.0°
CAXCAYCAZH4180.0°179.8°
CAXCAYCAZCBA0.7°0.2°
CAYCAXCBCH1178.8°180.0°
CAXCAYCAZH3179.3°179.8°
CAYCAXNAWH535.4°33.3°
CBCCBBCBDCBA177.7°179.7°
CBCCBBCBACAZ1.2°0.2°
CBCCBBCBDFBE60.8°179.7°
CBCCBBCBDFBG56.7°59.7°
CBCCBBCBDFBF177.5°60.3°
CBCCBBCBAH2178.8°179.7°
CAYCAZCBACBB0.8°0.0°
CAYCAZCBAH3180.0°180.0°
CAYCAZCBAH2179.2°179.9°
CBDCBBCBACAZ178.8°180.0°
CBBCBDFBEFBG122.7°120.0°
CBBCBDFBEFBF125.5°120.0°
CBBCBDFBGFBF125.3°120.0°
CBDCBBCBCH11.0°0.0°
CBDCBBCBAH21.2°0.0°
CBBCBACAZH2180.0°179.9°
CBACBBCBDFBE116.9°0.0°
CBACBBCBDFBG125.6°120.0°
CBACBBCBDFBF4.8°120.0°
CBACBBCBCH1178.6°179.7°
CBBCBACAZH3179.1°180.0°
CBACAZCAYH4179.3°180.0°
FBECBDFBGFBF112.9°120.0°
H2CBACAZH30.8°0.1°
H3CAZCAYH40.7°0.0°
H6CAGCAHH760.4°177.8°
H6CAGCAHH8179.8°57.7°
H6CAGCAFH11178.3°57.7°
H6CAGCAFH1258.3°177.7°
H7CAHCAIH958.0°59.3°
H7CAHCAIH1062.0°179.2°
H8CAHCAIH9177.3°60.9°
H8CAHCAIH1057.3°59.1°
H11CAFCAEH1357.9°59.1°
H11CAFCAEH14176.9°60.8°
H12CAFCAEH1362.3°179.2°
H12CAFCAEH1456.8°59.3°
H16CACCABH18177.7°179.9°
H16CACCABH1963.5°60.0°
H17CACCABH1860.2°60.0°
H17CACCABH19179.0°180.0°
H18CABCAAH2059.4°179.9°
H18CABCAAH2160.6°60.0°
H18CABCAAH22179.4°60.0°
H19CABCAAH2059.4°60.1°
H19CABCAAH21179.4°180.0°
H19CABCAAH2260.6°60.0°
H20CAAH21H22119.9°120.0°
H27CANCAMH281.1°0.2°

223532

PDB entries from 2024-08-07

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