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SummaryGeometryRelated PDB entries

3B4

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
CAPCAJsing1.53Å1.43Å
CAHCAJsing1.53Å1.52Å
CAJHAJsing1.09Å1.10Å
CAJHAJAsing1.09Å1.10Å
CAGCAHsing1.53Å1.55Å
CAHHAHsing1.09Å1.10Å
CAHHAHAsing1.09Å1.10Å
CAICAGsing1.53Å1.47Å
CAGHAGsing1.09Å1.10Å
CAGHAGAsing1.09Å1.10Å
CAKCAIsing1.53Å1.54Å
CAIHAIsing1.09Å1.10Å
CAIHAIAsing1.09Å1.10Å
CAKCAPsing1.53Å1.59Å
CAKHAKsing1.09Å1.10Å
CAKHAKAsing1.09Å1.10Å
CAPNALsing1.47Å1.52Å
CAPHAPsing1.09Å1.10Å
NALCANsing1.39Å1.39Å
NALHNALsing0.97Å1.00Å
CAECANdoub1.39Å1.39ÅAromatic
CANCAOsing1.40Å1.40ÅAromatic
CAECACsing1.38Å1.36ÅAromatic
CAEHAEsing1.08Å1.08Å
CACCADdoub1.39Å1.37ÅAromatic
CACHACsing1.08Å1.08Å
CADCAFsing1.38Å1.39ÅAromatic
CADHADsing1.08Å1.08Å
CAOCAFdoub1.40Å1.40ÅAromatic
CAFHAFsing1.08Å1.08Å
CAOCAMsing1.47Å1.51Å
OAACAMdoub1.21Å1.22Å
CAMOABsing1.35Å1.22Å
OABHOABsing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
CAPCAJCAH110.7°109.5°
CAPCAJHAJ109.1°109.5°
CAPCAJHAJA108.8°109.5°
CAJCAPCAK109.2°109.5°
CAJCAPNAL110.4°109.5°
CAJCAPHAP107.7°109.5°
CAHCAJHAJ109.0°109.5°
CAHCAJHAJA108.8°109.5°
CAJCAHCAG110.1°109.4°
CAJCAHHAH109.3°109.5°
CAJCAHHAHA109.1°109.5°
HAJCAJHAJA110.4°109.5°
CAGCAHHAH109.3°109.5°
CAGCAHHAHA109.1°109.4°
CAHCAGCAI114.1°109.5°
CAHCAGHAG108.0°109.5°
CAHCAGHAGA106.9°109.5°
HAHCAHHAHA109.9°109.5°
CAICAGHAG108.0°109.5°
CAICAGHAGA106.9°109.5°
CAGCAICAK112.5°109.5°
CAGCAIHAI108.5°109.5°
CAGCAIHAIA107.8°109.5°
HAGCAGHAGA113.2°109.4°
CAKCAIHAI108.5°109.4°
CAKCAIHAIA107.8°109.5°
CAICAKCAP113.3°109.5°
CAICAKHAK108.2°109.5°
CAICAKHAKA107.3°109.4°
HAICAIHAIA111.9°109.5°
CAPCAKHAK108.2°109.5°
CAPCAKHAKA107.3°109.5°
CAKCAPNAL104.8°109.5°
CAKCAPHAP112.9°109.5°
HAKCAKHAKA112.5°109.4°
NALCAPHAP111.9°109.5°
CAPNALCAN119.4°120.0°
CAPNALHNAL106.3°120.0°
CANNALHNAL106.3°120.0°
NALCANCAE116.4°120.1°
NALCANCAO122.1°120.2°
CAECANCAO121.5°119.6°
CANCAECAC119.5°120.0°
CANCAEHAE120.3°120.0°
CANCAOCAF117.9°119.6°
CANCAOCAM121.3°120.2°
CACCAEHAE120.3°120.0°
CAECACCAD120.6°120.4°
CAECACHAC119.7°119.7°
CADCACHAC119.7°119.8°
CACCADCAF121.0°120.3°
CACCADHAD119.5°119.8°
CAFCADHAD119.5°119.9°
CADCAFCAO119.4°120.0°
CADCAFHAF120.3°120.0°
CAOCAFHAF120.3°120.0°
CAFCAOCAM120.8°120.2°
CAOCAMOAA119.8°120.0°
CAOCAMOAB116.6°120.0°
OAACAMOAB123.6°120.0°
CAMOABHOAB109.5°117.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
CAPCAJCAHHAJ120.0°120.0°
CAPCAJCAHHAJA119.5°120.0°
CAPCAJHAJHAJA119.5°120.0°
CAPCAJCAHCAG62.3°60.0°
CAPCAJCAHHAH57.7°60.0°
CAPCAJCAHHAHA177.9°180.0°
CAJCAPCAKCAI53.1°60.0°
CAJCAPCAKNAL118.2°120.0°
CAJCAPCAKHAP119.7°120.0°
CAJCAPCAKHAK173.1°180.0°
CAJCAPCAKHAKA65.2°60.0°
CAJCAPNALHAP119.8°120.0°
CAJCAPNALCAN48.3°85.0°
CAJCAPNALHNAL168.3°95.0°
CAHCAJHAJHAJA119.5°120.0°
CAJCAHCAGHAH120.0°120.0°
CAJCAHCAGHAHA119.8°120.0°
CAJCAHHAHHAHA119.7°120.1°
CAJCAHCAGCAI53.5°60.0°
CAJCAHCAGHAG173.5°180.0°
CAJCAHCAGHAGA64.4°60.0°
CAHCAJCAPCAK61.4°60.0°
CAHCAJCAPNAL176.1°180.0°
CAHCAJCAPHAP61.6°60.0°
HAJCAJCAHCAG177.7°60.0°
HAJCAJCAHHAH62.3°180.0°
HAJCAJCAHHAHA57.9°60.0°
HAJCAJCAPCAK178.7°60.0°
HAJCAJCAPNAL63.9°60.0°
HAJCAJCAPHAP58.4°180.0°
HAJACAJCAHCAG57.2°180.0°
HAJACAJCAHHAH177.2°60.0°
HAJACAJCAHHAHA62.6°60.0°
HAJACAJCAPCAK58.1°180.0°
HAJACAJCAPNAL56.6°60.0°
HAJACAJCAPHAP178.9°60.0°
CAGCAHHAHHAHA119.8°120.0°
CAHCAGCAIHAG120.0°120.0°
CAHCAGCAIHAGA118.0°120.0°
CAHCAGHAGHAGA118.1°120.0°
CAHCAGCAICAK45.6°60.0°
CAHCAGCAIHAI74.4°60.0°
CAHCAGCAIHAIA164.3°180.0°
HAHCAHCAGCAI66.5°60.0°
HAHCAHCAGHAG53.5°60.0°
HAHCAHCAGHAGA175.6°180.0°
HAHACAHCAGCAI173.3°180.0°
HAHACAHCAGHAG66.7°60.0°
HAHACAHCAGHAGA55.3°60.0°
CAICAGHAGHAGA118.1°120.0°
CAGCAICAKHAI120.0°119.9°
CAGCAICAKHAIA118.7°120.1°
CAGCAIHAIHAIA118.7°120.0°
CAGCAICAKCAP44.9°60.0°
CAGCAICAKHAK164.8°180.0°
CAGCAICAKHAKA73.5°60.1°
HAGCAGCAICAK165.6°180.0°
HAGCAGCAIHAI45.6°60.0°
HAGCAGCAIHAIA75.7°60.0°
HAGACAGCAICAK72.3°60.0°
HAGACAGCAIHAI167.7°180.0°
HAGACAGCAIHAIA46.4°60.0°
CAKCAIHAIHAIA118.8°120.0°
CAICAKCAPHAK120.0°120.0°
CAICAKCAPHAKA118.3°120.0°
CAICAKHAKHAKA118.4°120.0°
CAICAKCAPNAL171.3°180.0°
CAICAKCAPHAP66.6°60.0°
HAICAICAKCAP75.1°60.0°
HAICAICAKHAK44.8°60.0°
HAICAICAKHAKA166.5°180.0°
HAIACAICAKCAP163.6°180.0°
HAIACAICAKHAK76.5°60.0°
HAIACAICAKHAKA45.2°60.0°
CAPCAKHAKHAKA118.4°120.0°
CAKCAPNALHAP122.7°120.0°
CAKCAPNALCAN165.8°155.0°
CAKCAPNALHNAL74.2°25.0°
HAKCAKCAPNAL68.6°60.0°
HAKCAKCAPHAP53.4°60.0°
HAKACAKCAPNAL53.0°60.0°
HAKACAKCAPHAP175.0°NaN°
CAPNALCANHNAL120.0°179.9°
CAPNALCANCAE57.8°5.5°
CAPNALCANCAO124.1°174.2°
HAPCAPNALCAN71.5°35.0°
HAPCAPNALHNAL48.5°145.1°
NALCANCAECAO178.1°179.6°
NALCANCAECAC178.3°180.0°
NALCANCAEHAE1.7°0.1°
NALCANCAOCAF177.5°179.7°
NALCANCAOCAM0.7°0.1°
HNALNALCANCAE62.2°174.5°
HNALNALCANCAO115.9°5.9°
CANCAECACHAE180.0°179.9°
CANCAECACCAD0.7°0.0°
CANCAECACHAC179.3°180.0°
CAECANCAOCAF0.5°0.6°
CAECANCAOCAM178.7°179.7°
CAOCANCAECAC0.2°0.3°
CAOCANCAEHAE179.8°179.7°
CANCAOCAFCAD2.2°0.6°
CANCAOCAFCAM178.2°179.6°
CANCAOCAFHAF177.8°179.7°
CANCAOCAMOAA14.8°5.6°
CANCAOCAMOAB168.2°174.4°
CAECACCADHAC180.0°180.0°
CAECACCADCAF2.4°0.0°
CAECACCADHAD177.6°180.0°
HAECAECACCAD179.3°180.0°
HAECAECACHAC0.7°0.0°
CACCADCAFHAD180.0°179.9°
CACCADCAFCAO3.2°0.3°
CACCADCAFHAF176.9°180.0°
HACCACCADCAF177.6°180.0°
HACCACCADHAD2.4°0.0°
CADCAFCAOHAF180.0°179.7°
CADCAFCAOCAM179.6°179.7°
HADCADCAFCAO176.9°179.7°
HADCADCAFHAF3.1°0.0°
CAFCAOCAMOAA163.3°174.1°
CAFCAOCAMOAB13.7°6.0°
HAFCAFCAOCAM0.4°0.0°
CAOCAMOAAOAB176.7°179.9°
CAOCAMOABHOAB176.9°180.0°
OAACAMOABHOAB0.0°0.0°

227344

PDB entries from 2024-11-13

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