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IX0

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
FBCCAZsing1.40Å1.23Å
CAYCAZsing1.53Å1.52Å
CAYNAXsing1.46Å1.46Å
CAZFBAsing1.40Å1.36Å
CAZFBBsing1.40Å1.35Å
OAVSAUdoub1.42Å1.54Å
OAWSAUdoub1.42Å1.53Å
SAUNAXsing1.66Å1.61Å
SAUCASsing1.81Å1.89Å
NAXCBDsing1.40Å1.33Å
CBICBDdoub1.39Å1.39ÅAromatic
CBICBHsing1.38Å1.40ÅAromatic
CBDCBEsing1.39Å1.39ÅAromatic
CARCASsing1.55Å1.55Å
CARCAQsing1.56Å1.49Å
CASCANsing1.59Å1.49Å
CBHCBGdoub1.39Å1.37ÅAromatic
OATCANsing1.46Å1.43Å
OATCAQsing1.47Å1.44Å
CBECBFdoub1.38Å1.40ÅAromatic
CANCAOsing1.53Å1.39Å
CAQCAPsing1.53Å1.44Å
CBGCBFsing1.39Å1.40ÅAromatic
CBGOBJsing1.36Å1.36Å
CAOCAPdoub1.36Å1.35Å
CAOCAKsing1.47Å1.31Å
CAPCBKsing1.47Å1.33Å
CBPCBKdoub1.40Å1.40ÅAromatic
CBPCBOsing1.38Å1.37ÅAromatic
CAKCAJdoub1.40Å1.41ÅAromatic
CAKCALsing1.40Å1.38ÅAromatic
CBKCBLsing1.40Å1.39ÅAromatic
CAJCAIsing1.38Å1.40ÅAromatic
CALCAMdoub1.38Å1.38ÅAromatic
CBOCBNdoub1.39Å1.38ÅAromatic
CAICAHdoub1.39Å1.40ÅAromatic
OAECAAdoub1.22Å1.22Å
CBLCBMdoub1.38Å1.39ÅAromatic
CAMCAHsing1.39Å1.41ÅAromatic
CAHNAFsing1.40Å1.32Å
CBNCBMsing1.39Å1.38ÅAromatic
CBNOBQsing1.36Å1.34Å
CAGCACsing1.51Å1.54Å
CAANAFsing1.35Å1.31Å
CAACABsing1.47Å1.58Å
CACCABdoub1.33Å1.54Å
CACCADsing1.51Å1.54Å
CADH1sing1.09Å1.10Å
CADH2sing1.09Å1.10Å
CADH3sing1.09Å1.10Å
CAGH4sing1.09Å1.10Å
CAGH5sing1.09Å1.10Å
CAGH6sing1.09Å1.10Å
CABH7sing1.08Å1.08Å
NAFH8sing0.97Å1.00Å
CAMH9sing1.08Å1.08Å
CALH10sing1.08Å1.08Å
CAIH11sing1.08Å1.08Å
CAJH12sing1.08Å1.08Å
CBLH15sing1.08Å1.08Å
CBMH16sing1.08Å1.08Å
OBQH17sing0.97Å0.95Å
CBOH18sing1.08Å1.08Å
CBPH19sing1.08Å1.08Å
CAQH20sing1.09Å1.10Å
CARH21sing1.09Å1.10Å
CARH22sing1.09Å1.10Å
CANH23sing1.09Å1.10Å
CASH24sing1.09Å1.10Å
CAYH25sing1.09Å1.10Å
CAYH26sing1.09Å1.10Å
CBEH27sing1.08Å1.08Å
CBFH28sing1.08Å1.08Å
OBJH29sing0.97Å0.95Å
CBHH30sing1.08Å1.08Å
CBIH31sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
FBCCAZCAY104.5°109.5°
FBCCAZFBA110.2°109.5°
FBCCAZFBB109.2°109.4°
CAZCAYNAX112.6°109.5°
CAYCAZFBA109.8°109.5°
CAYCAZFBB112.7°109.5°
CAZCAYH25108.7°109.5°
CAZCAYH26108.7°109.5°
CAYNAXSAU113.8°120.0°
CAYNAXCBD127.0°120.0°
NAXCAYH25108.7°109.5°
NAXCAYH26108.7°109.4°
FBACAZFBB110.4°109.5°
OAVSAUOAW112.0°121.0°
OAVSAUNAX112.0°104.3°
OAVSAUCAS110.6°110.6°
OAWSAUNAX105.6°104.3°
OAWSAUCAS104.0°110.5°
NAXSAUCAS112.3°104.5°
SAUNAXCBD117.3°120.0°
SAUCASCAR105.2°110.9°
SAUCASCAN108.8°110.6°
SAUCASH24109.6°110.8°
NAXCBDCBI118.4°120.0°
NAXCBDCBE122.9°120.1°
CBDCBICBH122.2°120.0°
CBICBDCBE118.7°119.9°
CBDCBIH31118.9°120.0°
CBICBHCBG118.9°120.0°
CBICBHH30120.5°120.0°
CBHCBIH31118.9°120.0°
CBDCBECBF118.8°120.0°
CBDCBEH27120.6°119.9°
CASCARCAQ97.6°102.0°
CARCASCAN103.1°101.7°
CASCARH21112.4°110.9°
CASCARH22112.4°111.0°
CARCASH24114.3°111.0°
CARCAQOAT98.6°101.7°
CARCAQCAP108.5°105.1°
CARCAQH20114.2°115.6°
CAQCARH21112.4°110.6°
CAQCARH22112.4°111.3°
CASCANOAT100.7°100.8°
CASCANCAO104.2°104.1°
CASCANH23114.4°117.0°
CANCASH24115.2°111.5°
CBHCBGCBF119.6°120.0°
CBHCBGOBJ118.5°120.0°
CBGCBHH30120.5°119.9°
CANOATCAQ94.3°97.2°
OATCANCAO103.9°100.8°
OATCANH23115.5°116.0°
OATCAQCAP103.8°100.7°
OATCAQH20115.0°116.0°
CBECBFCBG121.7°120.0°
CBFCBEH27120.6°120.1°
CBECBFH28119.1°120.0°
CANCAOCAP105.0°106.0°
CANCAOCAK119.8°127.1°
CAOCANH23116.2°115.7°
CAQCAPCAO105.6°106.0°
CAQCAPCBK121.1°127.0°
CAPCAQH20115.0°115.7°
CBFCBGOBJ121.8°119.9°
CBGCBFH28119.1°120.0°
CBGOBJH29109.5°113.9°
CAPCAOCAK133.1°127.0°
CAOCAPCBK133.0°127.0°
CAOCAKCAJ122.0°120.1°
CAOCAKCAL117.2°120.1°
CAPCBKCBP118.6°120.1°
CAPCBKCBL123.4°120.1°
CBKCBPCBO121.9°119.9°
CBPCBKCBL118.0°119.8°
CBKCBPH19119.0°120.1°
CBPCBOCBN119.4°120.1°
CBPCBOH18120.3°119.9°
CBOCBPH19119.1°120.1°
CAJCAKCAL120.5°119.9°
CAKCAJCAI121.9°119.9°
CAKCAJH12119.1°120.1°
CAKCALCAM118.2°119.9°
CAKCALH10120.9°120.1°
CBKCBLCBM120.2°119.9°
CBKCBLH15119.9°120.1°
CAJCAICAH116.7°120.1°
CAJCAIH11121.6°119.9°
CAICAJH12119.0°120.0°
CALCAMCAH121.7°120.1°
CALCAMH9119.2°120.0°
CAMCALH10120.9°120.0°
CBOCBNCBM120.3°120.2°
CBOCBNOBQ119.1°119.9°
CBNCBOH18120.3°119.9°
CAICAHCAM121.0°120.2°
CAICAHNAF128.0°119.9°
CAHCAIH11121.7°119.9°
OAECAANAF121.9°120.0°
OAECAACAB125.6°120.0°
CBLCBMCBN120.3°120.1°
CBMCBLH15119.9°120.1°
CBLCBMH16119.9°120.0°
CAMCAHNAF111.0°119.9°
CAHCAMH9119.2°120.0°
CAHNAFCAA123.0°120.0°
CAHNAFH8118.5°120.0°
CBMCBNOBQ120.6°119.9°
CBNCBMH16119.9°119.9°
CBNOBQH17109.5°114.0°
CAGCACCAB121.7°120.0°
CAGCACCAD119.1°120.0°
CACCAGH4109.5°109.4°
CACCAGH5109.5°109.5°
CACCAGH6109.4°109.5°
NAFCAACAB112.4°120.1°
CAANAFH8118.5°120.0°
CAACABCAC124.3°120.0°
CAACABH7117.8°119.9°
CABCACCAD119.2°120.0°
CACCABH7117.9°120.0°
CACCADH1109.5°109.5°
CACCADH2109.5°109.4°
CACCADH3109.5°109.5°
H1CADH2109.5°109.5°
H1CADH3109.5°109.5°
H2CADH3109.5°109.4°
H4CAGH5109.4°109.4°
H4CAGH6109.4°109.5°
H5CAGH6109.5°109.5°
H21CARH22109.5°110.8°
H25CAYH26109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
FBCCAZCAYFBA118.2°120.1°
FBCCAZCAYFBB118.4°120.0°
FBCCAZCAYNAX176.6°60.0°
FBCCAZFBAFBB120.7°120.0°
FBCCAZCAYH2556.1°180.0°
FBCCAZCAYH2662.9°60.0°
CAZCAYNAXH25120.5°120.0°
CAZCAYNAXH26120.4°120.0°
CAYCAZFBAFBB124.8°120.0°
CAZCAYNAXSAU139.7°95.0°
CAZCAYNAXCBD56.4°85.0°
CAZCAYH25H26118.6°120.0°
NAXCAYCAZFBA65.2°60.1°
NAXCAYCAZFBB58.2°180.0°
CAYNAXSAUOAV35.7°22.8°
CAYNAXSAUOAW86.4°150.6°
CAYNAXSAUCBD165.5°180.0°
CAYNAXSAUCAS161.0°93.3°
CAYNAXCBDCBI86.7°144.1°
CAYNAXCBDCBE94.3°35.6°
NAXCAYH25H26118.6°120.0°
FBACAZCAYH25174.3°60.0°
FBACAZCAYH2655.3°180.0°
FBBCAZCAYH2562.2°60.0°
FBBCAZCAYH26178.7°60.0°
OAVSAUOAWNAX122.1°116.7°
OAVSAUOAWCAS119.5°131.5°
OAVSAUNAXCAS125.2°116.1°
OAVSAUNAXCBD158.8°157.2°
OAVSAUCASCAR50.7°50.7°
OAVSAUCASCAN59.2°61.4°
OAVSAUCASH24174.0°174.5°
OAWSAUNAXCAS112.7°116.1°
OAWSAUNAXCBD79.1°29.4°
OAWSAUCASCAR69.7°172.5°
OAWSAUCASCAN179.6°75.4°
OAWSAUCASH2453.6°48.8°
SAUNAXCBDCBI76.7°35.9°
SAUNAXCBDCBE102.4°144.4°
NAXSAUCASCAR176.7°60.9°
NAXSAUCASCAN66.7°173.0°
NAXSAUCASH2460.1°62.8°
SAUNAXCAYH2519.3°145.0°
SAUNAXCAYH2699.8°25.0°
CASSAUNAXCBD33.5°86.7°
SAUCASCARCAN114.0°117.7°
SAUCASCARH24120.3°123.7°
SAUCASCARCAQ126.1°118.2°
SAUCASCANH24123.5°123.8°
SAUCASCANOAT83.9°83.7°
SAUCASCANCAO168.6°172.1°
SAUCASCARH218.0°124.1°
SAUCASCARH22115.9°0.5°
SAUCASCANH2340.6°43.0°
NAXCBDCBICBE179.1°179.7°
NAXCBDCBICBH179.3°179.7°
NAXCBDCBECBF179.6°179.9°
CBDNAXCAYH25176.9°35.0°
CBDNAXCAYH2664.0°155.0°
NAXCBDCBEH270.4°0.1°
NAXCBDCBIH310.7°0.0°
CBDCBICBHH31180.0°179.7°
CBDCBICBHCBG0.2°0.6°
CBICBDCBECBF0.6°0.3°
CBICBDCBEH27179.4°179.8°
CBDCBICBHH30179.8°179.7°
CBHCBICBDCBE0.2°0.6°
CBICBHCBGH30180.0°179.8°
CBICBHCBGCBF0.3°0.3°
CBICBHCBGOBJ179.9°179.7°
CBDCBECBFH27180.0°179.9°
CBDCBECBFCBG0.5°0.0°
CBDCBECBFH28179.5°180.0°
CBECBDCBIH31179.8°179.7°
CASCARCAQH21118.0°118.0°
CASCARCAQH22118.0°118.4°
CARCASCANH24125.1°118.3°
CARCASCANOAT27.4°34.2°
CASCARCAQOAT47.5°35.0°
CARCASCANCAO80.0°70.1°
CASCARCAQCAP60.2°69.6°
CASCARCAQH20170.0°161.6°
CASCARH21H22125.6°123.7°
CARCASCANH23151.9°160.8°
CAQCARCASCAN12.1°0.5°
CARCAQOATCAN66.7°57.7°
CARCAQOATCAP111.6°108.0°
CARCAQOATH20121.9°126.4°
CARCAQCAPH20129.3°128.8°
CARCAQCAPCAO79.2°73.3°
CARCAQCAPCBK105.8°106.8°
CAQCARH21H22125.6°123.9°
CAQCARCASH24113.7°118.2°
CASCANOATCAO107.7°106.8°
CASCANOATH23123.8°127.3°
CASCANOATCAQ57.1°56.6°
CASCANCAOH23126.9°129.8°
CASCANCAOCAP66.9°72.4°
CASCANCAOCAK98.5°107.9°
CANCASCARH21106.0°118.2°
CANCASCARH22130.1°118.1°
CBHCBGCBFCBE0.1°0.0°
CBHCBGCBFOBJ179.6°180.0°
CBHCBGCBFH28180.0°179.9°
CBHCBGOBJH29180.0°89.9°
CBGCBHCBIH31179.8°179.7°
OATCANCAOH23128.1°126.0°
CANOATCAQCAP44.9°50.4°
OATCANCAOCAP38.1°31.8°
OATCANCAOCAK156.5°147.9°
CANOATCAQH20171.4°176.0°
OATCANCASH24152.5°152.5°
CAQOATCANCAO50.6°50.2°
OATCAQCAPH20126.5°125.8°
OATCAQCAPCAO25.0°32.1°
OATCAQCAPCBK150.1°147.8°
OATCAQCARH2170.5°153.0°
OATCAQCARH22165.5°83.4°
CAQOATCANH23179.1°176.1°
CBECBFCBGH28180.0°179.9°
CBECBFCBGOBJ179.5°180.0°
CANCAOCAPCAQ7.6°0.3°
CANCAOCAPCAK162.6°179.7°
CANCAOCAPCBK178.2°179.7°
CANCAOCAKCAJ54.9°115.3°
CANCAOCAKCAL119.9°64.4°
CAOCANCASH2445.1°48.3°
CAQCAPCAOCBK174.2°180.0°
CAQCAPCAOCAK170.2°180.0°
CAQCAPCBKCBP28.4°64.7°
CAQCAPCBKCBL149.1°114.9°
CAPCAQCARH21178.3°48.4°
CAPCAQCARH2257.8°172.0°
CBGCBFCBEH27179.5°179.9°
CBFCBGOBJH290.4°90.0°
CBFCBGCBHH30179.7°180.0°
OBJCBGCBFH280.5°0.0°
OBJCBGCBHH300.1°0.1°
CAOCAPCBKCBP158.1°115.3°
CAPCAOCAKCAJ144.5°65.0°
CAPCAOCAKCAL40.6°115.3°
CAOCAPCBKCBL24.3°65.0°
CAOCAPCAQH20151.5°157.9°
CAPCAOCANH23166.1°157.8°
CAKCAOCAPCBK15.7°0.0°
CAOCAKCAJCAL174.7°179.7°
CAOCAKCAJCAI176.9°180.0°
CAOCAKCALCAM176.9°179.9°
CAOCAKCALH103.1°0.1°
CAOCAKCAJH123.0°0.0°
CAKCAOCANH2328.4°22.0°
CAPCBKCBPCBL177.7°179.7°
CAPCBKCBPCBO179.6°179.7°
CAPCBKCBLCBM177.8°180.0°
CAPCBKCBLH152.2°0.1°
CAPCBKCBPH190.4°0.0°
CBKCAPCAQH2023.5°22.1°
CBKCBPCBOH19180.0°179.7°
CBKCBPCBOCBN2.8°0.6°
CBPCBKCBLCBM0.2°0.4°
CBPCBKCBLH15179.8°179.8°
CBKCBPCBOH18177.2°179.7°
CBOCBPCBKCBL1.9°0.6°
CBPCBOCBNH18180.0°179.7°
CBPCBOCBNCBM2.0°0.2°
CBPCBOCBNOBQ178.2°179.7°
CAKCAJCAIH12180.0°180.0°
CAJCAKCALCAM2.0°0.3°
CAKCAJCAICAH1.0°0.1°
CAJCAKCALH10178.0°179.7°
CAKCAJCAIH11179.0°180.0°
CALCAKCAJCAI2.3°0.3°
CAKCALCAMH10180.0°180.0°
CAKCALCAMCAH0.6°0.0°
CAKCALCAMH9179.4°180.0°
CALCAKCAJH12177.7°179.7°
CBKCBLCBMH15180.0°179.9°
CBKCBLCBMCBN0.5°0.0°
CBKCBLCBMH16179.5°179.9°
CBLCBKCBPH19178.1°179.7°
CAJCAICAHH11180.0°179.9°
CAJCAICAHCAM0.5°0.2°
CAJCAICAHNAF176.9°180.0°
CALCAMCAHCAI0.7°0.3°
CALCAMCAHH9180.0°179.9°
CALCAMCAHNAF177.1°180.0°
CBOCBNCBMCBL0.4°0.0°
CBOCBNCBMOBQ179.8°180.0°
CBOCBNCBMH16179.6°180.0°
CBOCBNOBQH17180.0°90.0°
CBNCBOCBPH19177.2°179.7°
CAICAHCAMNAF177.8°179.8°
CAICAHNAFCAA67.3°42.0°
CAICAHNAFH8112.7°137.9°
CAICAHCAMH9179.3°179.8°
CAHCAICAJH12179.0°179.9°
OAECAANAFCAH11.9°4.5°
OAECAANAFCAB176.7°179.9°
OAECAACABCAC0.8°8.4°
OAECAACABH7179.2°171.6°
OAECAANAFH8168.1°175.6°
CBLCBMCBNH16180.0°180.0°
CBLCBMCBNOBQ179.8°180.0°
CAMCAHNAFCAA115.1°138.2°
CAMCAHNAFH864.9°41.8°
CAHCAMCALH10179.4°180.0°
CAMCAHCAIH11179.5°179.7°
CAHNAFCAAH8180.0°179.9°
CAHNAFCAACAB171.4°175.6°
NAFCAHCAMH92.9°0.0°
NAFCAHCAIH113.1°0.1°
CBNCBMCBLH15179.5°179.9°
CBMCBNOBQH170.2°90.0°
CBMCBNCBOH18178.0°180.0°
OBQCBNCBMH160.2°0.1°
OBQCBNCBOH181.8°0.0°
CAGCACCABCAA0.2°19.5°
CAGCACCABCAD179.3°180.0°
CAGCACCADH1180.0°90.0°
CAGCACCADH260.0°30.1°
CAGCACCADH360.0°150.0°
CACCAGH4H5120.0°119.9°
CACCAGH4H6120.0°120.0°
CACCAGH5H6120.0°120.0°
CAGCACCABH7179.8°160.5°
NAFCAACABCAC177.4°171.5°
NAFCAACABH72.6°8.4°
CAACABCACH7180.0°180.0°
CAACABCACCAD179.1°160.5°
CABCAANAFH88.6°4.3°
CABCACCADH10.7°90.0°
CABCACCADH2120.7°150.0°
CABCACCADH3119.3°30.1°
CABCACCAGH4180.0°7.6°
CABCACCAGH560.0°127.5°
CABCACCAGH660.0°112.4°
CACCADH1H2120.0°120.0°
CACCADH1H3120.0°120.1°
CACCADH2H3120.0°119.9°
CADCACCAGH40.7°172.4°
CADCACCAGH5120.7°52.5°
CADCACCAGH6119.3°67.5°
CADCACCABH70.9°19.5°
H1CADH2H3120.0°120.0°
H4CAGH5H6120.0°120.0°
H9CAMCALH100.6°0.0°
H11CAICAJH121.0°0.0°
H15CBLCBMH160.5°0.1°
H18CBOCBPH192.8°0.0°
H20CAQCARH2151.9°80.4°
H20CAQCARH2272.0°43.2°
H21CARCASH24128.3°0.4°
H22CARCASH244.3°123.2°
H23CANCASH2483.0°80.8°
H27CBECBFH280.5°0.1°
H30CBHCBIH310.2°0.0°

222415

PDB entries from 2024-07-10

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