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B6H

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CAGCAAsing1.53Å1.53Å
CAGCAXsing1.51Å1.54Å
NATCAXsing1.35Å1.35Å
NATCAZsing1.39Å1.34Å
CAXOAEdoub1.21Å1.23Å
CAZCAHdoub1.39Å1.40ÅAromatic
CAZCAIsing1.39Å1.40ÅAromatic
CAHCAJsing1.38Å1.40ÅAromatic
CAICAKdoub1.38Å1.40ÅAromatic
CAJCBBdoub1.40Å1.40ÅAromatic
CAKCBBsing1.40Å1.40ÅAromatic
CBBCAYsing1.48Å1.40Å
OAFCAYdoub1.22Å1.23Å
CAYCBGsing1.41Å1.35Å
CBGSAWsing1.76Å1.65ÅAromatic
CBGCBAdoub1.38Å1.35ÅAromatic
NADCBAsing1.39Å1.33Å
SAWCBEsing1.71Å1.65ÅAromatic
CBANASsing1.31Å1.35ÅAromatic
NASCBEdoub1.30Å1.34ÅAromatic
CBENAUsing1.38Å1.34Å
CAOCAQsing1.53Å1.51Å
CAONBHsing1.47Å1.49Å
CAQNBIsing1.47Å1.50Å
OAVCBFsing1.36Å1.37Å
OAVCABsing1.43Å1.44Å
CBFCANdoub1.38Å1.40ÅAromatic
CBFCBDsing1.39Å1.40ÅAromatic
CANCBCsing1.39Å1.40ÅAromatic
NAUCBDsing1.40Å1.34Å
CBDCAMdoub1.39Å1.40ÅAromatic
CBCNBIsing1.40Å1.35Å
CBCCALdoub1.39Å1.40ÅAromatic
NBICARsing1.47Å1.49Å
CACNBHsing1.47Å1.49Å
NBHCAPsing1.47Å1.47Å
CAMCALsing1.38Å1.39ÅAromatic
CAPCARsing1.53Å1.52Å
CAQH1sing1.09Å1.10Å
CAQH2sing1.09Å1.10Å
CAOH3sing1.09Å1.10Å
CAOH4sing1.09Å1.10Å
CACH6sing1.09Å1.10Å
CACH7sing1.09Å1.10Å
CACH8sing1.09Å1.10Å
CAPH9sing1.09Å1.10Å
CAPH10sing1.09Å1.10Å
CARH11sing1.09Å1.10Å
CARH12sing1.09Å1.10Å
CANH13sing1.08Å1.08Å
CABH14sing1.09Å1.10Å
CABH15sing1.09Å1.10Å
CABH16sing1.09Å1.10Å
CALH17sing1.08Å1.08Å
CAMH18sing1.08Å1.08Å
NAUH19sing0.97Å1.00Å
NADH20sing0.97Å1.00Å
NADH21sing0.97Å1.00Å
CAKH22sing1.08Å1.08Å
CAIH23sing1.08Å1.08Å
CAJH24sing1.08Å1.08Å
CAHH25sing1.08Å1.08Å
NATH26sing0.97Å1.00Å
CAGH27sing1.09Å1.10Å
CAGH28sing1.09Å1.10Å
CAAH29sing1.09Å1.10Å
CAAH30sing1.09Å1.10Å
CAAH31sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CAACAGCAX120.6°109.5°
CAACAGH27106.6°109.4°
CAACAGH28106.6°109.5°
CAGCAAH29109.5°109.5°
CAGCAAH30109.5°109.5°
CAGCAAH31109.5°109.5°
CAGCAXNAT114.1°120.0°
CAGCAXOAE120.4°120.0°
CAXCAGH27106.6°109.5°
CAXCAGH28106.6°109.5°
CAXNATCAZ120.9°120.0°
NATCAXOAE125.5°120.0°
CAXNATH26119.5°119.9°
NATCAZCAH121.6°120.0°
NATCAZCAI119.4°119.9°
CAZNATH26119.6°120.0°
CAHCAZCAI118.9°120.1°
CAZCAHCAJ120.4°120.1°
CAZCAHH25119.8°120.0°
CAZCAICAK120.6°120.0°
CAZCAIH23119.7°120.0°
CAHCAJCBB120.9°119.9°
CAHCAJH24119.6°120.1°
CAJCAHH25119.8°119.9°
CAICAKCBB120.7°119.9°
CAICAKH22119.7°120.0°
CAKCAIH23119.7°119.9°
CAJCBBCAK118.5°119.9°
CAJCBBCAY122.5°120.1°
CBBCAJH24119.5°120.1°
CAKCBBCAY119.0°120.1°
CBBCAKH22119.7°120.0°
CBBCAYOAF119.2°119.9°
CBBCAYCBG120.1°120.0°
OAFCAYCBG120.8°120.0°
CAYCBGSAW127.4°126.1°
CAYCBGCBA125.1°126.2°
SAWCBGCBA107.5°107.7°
CBGSAWCBE96.0°90.6°
CBGCBANAD126.9°123.2°
CBGCBANAS114.2°113.6°
NADCBANAS118.8°123.2°
CBANADH20109.5°120.0°
CBANADH21109.5°120.0°
SAWCBENAS108.1°110.8°
SAWCBENAU128.1°124.6°
CBANASCBE114.3°117.3°
NASCBENAU123.8°124.6°
CBENAUCBD120.0°120.0°
CBENAUH19120.0°119.9°
CAQCAONBH110.9°109.4°
CAOCAQNBI113.5°109.4°
CAOCAQH1108.5°109.5°
CAOCAQH2108.5°109.5°
CAQCAOH3109.1°109.5°
CAQCAOH4109.1°109.5°
CAONBHCAC112.3°111.0°
CAONBHCAP111.6°110.9°
NBHCAOH3109.1°109.5°
NBHCAOH4109.1°109.5°
CAQNBICBC118.3°111.0°
CAQNBICAR122.5°110.9°
NBICAQH1108.5°109.5°
NBICAQH2108.5°109.4°
CBFOAVCAB112.6°117.0°
OAVCBFCAN122.3°120.1°
OAVCBFCBD117.4°120.0°
OAVCABH14109.5°109.4°
OAVCABH15109.4°109.5°
OAVCABH16109.4°109.4°
CANCBFCBD120.3°119.9°
CBFCANCBC120.0°120.0°
CBFCANH13120.0°120.0°
CBFCBDNAU117.5°120.0°
CBFCBDCAM119.6°120.0°
CANCBCNBI120.8°120.0°
CANCBCCAL119.5°120.0°
CBCCANH13120.0°120.0°
NAUCBDCAM122.9°120.0°
CBDNAUH19120.0°120.1°
CBDCAMCAL120.1°120.0°
CBDCAMH18120.0°120.0°
NBICBCCAL119.6°119.9°
CBCNBICAR119.1°111.0°
CBCCALCAM120.5°120.1°
CBCCALH17119.8°120.0°
NBICARCAP111.3°109.4°
NBICARH11109.0°109.5°
NBICARH12109.0°109.5°
CACNBHCAP108.9°111.0°
NBHCACH6109.5°109.4°
NBHCACH7109.5°109.5°
NBHCACH8109.5°109.5°
NBHCAPCAR105.3°109.4°
NBHCAPH9110.5°109.5°
NBHCAPH10110.5°109.5°
CAMCALH17119.8°119.9°
CALCAMH18119.9°120.0°
CARCAPH9110.5°109.5°
CARCAPH10110.5°109.5°
CAPCARH11109.0°109.5°
CAPCARH12109.0°109.5°
H1CAQH2109.5°109.5°
H3CAOH4109.5°109.5°
H6CACH7109.4°109.4°
H6CACH8109.5°109.5°
H7CACH8109.5°109.5°
H9CAPH10109.5°109.5°
H11CARH12109.5°109.4°
H14CABH15109.5°109.5°
H14CABH16109.5°109.5°
H15CABH16109.5°109.5°
H20NADH21109.5°120.1°
H27CAGH28109.4°109.4°
H29CAAH30109.5°109.5°
H29CAAH31109.4°109.4°
H30CAAH31109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CAACAGCAXH27121.6°120.0°
CAACAGCAXH28121.6°120.1°
CAACAGCAXNAT179.9°180.0°
CAACAGCAXOAE0.3°0.0°
CAACAGH27H28115.0°120.0°
CAGCAAH29H30120.0°120.0°
CAGCAAH29H31120.0°120.0°
CAGCAAH30H31120.0°120.0°
CAGCAXNATOAE179.8°180.0°
CAGCAXNATCAZ179.7°175.6°
CAGCAXNATH260.4°4.4°
CAXCAGH27H28115.0°120.0°
CAXCAGCAAH29180.0°60.0°
CAXCAGCAAH3060.0°60.0°
CAXCAGCAAH3160.0°180.0°
CAXNATCAZH26180.0°180.0°
CAXNATCAZCAH59.5°138.5°
CAXNATCAZCAI122.4°41.8°
NATCAXCAGH2758.5°60.0°
NATCAXCAGH2858.4°59.9°
CAZNATCAXOAE0.1°4.3°
NATCAZCAHCAI178.1°179.7°
NATCAZCAHCAJ178.8°180.0°
NATCAZCAICAK179.1°180.0°
NATCAZCAIH230.9°0.0°
NATCAZCAHH251.2°0.0°
OAECAXNATH26179.9°175.6°
OAECAXCAGH27121.3°120.0°
OAECAXCAGH28121.8°120.1°
CAZCAHCAJH25180.0°180.0°
CAHCAZCAICAK1.0°0.3°
CAZCAHCAJCBB0.5°0.1°
CAHCAZCAIH23179.0°179.8°
CAZCAHCAJH24179.5°180.0°
CAHCAZNATH26120.5°41.5°
CAICAZCAHCAJ0.7°0.2°
CAZCAICAKH23180.0°180.0°
CAZCAICAKCBB0.0°0.0°
CAZCAICAKH22180.0°180.0°
CAICAZCAHH25179.3°179.7°
CAICAZNATH2657.6°138.2°
CAHCAJCBBH24180.0°179.9°
CAHCAJCBBCAK1.4°0.4°
CAHCAJCBBCAY179.3°180.0°
CAICAKCBBCAJ1.2°0.4°
CAICAKCBBH22180.0°180.0°
CAICAKCBBCAY179.1°180.0°
CAJCBBCAKCAY178.0°179.6°
CAJCBBCAYOAF123.0°30.1°
CAJCBBCAYCBG57.6°149.9°
CAJCBBCAKH22178.9°179.7°
CBBCAJCAHH25179.5°180.0°
CAKCBBCAYOAF55.0°150.3°
CAKCBBCAYCBG124.5°29.7°
CBBCAKCAIH23180.0°179.9°
CAKCBBCAJH24178.6°179.7°
CBBCAYOAFCBG179.5°180.0°
CBBCAYCBGSAW2.5°6.8°
CBBCAYCBGCBA177.5°173.4°
CAYCBBCAKH220.9°0.1°
CAYCBBCAJH240.7°0.1°
OAFCAYCBGSAW176.9°173.2°
OAFCAYCBGCBA3.0°6.6°
CAYCBGSAWCBA180.0°179.9°
CAYCBGCBANAD0.1°0.0°
CAYCBGSAWCBE179.9°180.0°
CAYCBGCBANAS180.0°179.9°
SAWCBGCBANAD179.9°179.8°
SAWCBGCBANAS0.0°0.1°
CBGSAWCBENAS0.1°0.2°
CBGSAWCBENAU179.9°180.0°
CBGCBANADNAS179.9°179.9°
CBACBGSAWCBE0.1°0.2°
CBGCBANASCBE0.1°0.1°
CBGCBANADH20179.9°179.9°
CBGCBANADH2159.9°0.1°
NADCBANASCBE180.0°180.0°
CBANADH20H21120.0°180.0°
SAWCBENASCBA0.1°0.2°
SAWCBENASNAU180.0°179.8°
SAWCBENAUCBD4.1°176.3°
SAWCBENAUH19175.9°3.6°
CBANASCBENAU179.9°180.0°
NASCBANADH200.0°0.0°
NASCBANADH21120.0°179.9°
NASCBENAUCBD175.9°3.4°
NASCBENAUH194.1°176.6°
CBENAUCBDCBF121.1°171.3°
CBENAUCBDH19180.0°179.9°
CBENAUCBDCAM60.4°8.9°
CAQCAONBHH3120.2°120.0°
CAQCAONBHH4120.2°120.0°
CAOCAQNBIH1120.6°120.0°
CAOCAQNBIH2120.6°120.0°
CAOCAQNBICBC162.6°176.8°
CAOCAQNBICAR20.6°59.3°
CAQCAONBHCAC175.3°176.8°
CAQCAONBHCAP62.1°59.3°
CAOCAQH1H2118.2°120.1°
CAQCAOH3H4119.3°120.1°
NBHCAOCAQNBI32.9°58.4°
CAONBHCACCAP124.1°123.8°
CAONBHCAPCAR72.4°59.3°
NBHCAOCAQH1153.5°178.4°
NBHCAOCAQH287.7°61.6°
NBHCAOH3H4119.3°120.0°
CAONBHCACH6180.0°60.0°
CAONBHCACH760.0°180.0°
CAONBHCACH860.0°60.0°
CAONBHCAPH9168.3°179.2°
CAONBHCAPH1047.0°60.7°
CAQNBICBCCAN120.4°179.7°
CAQNBICBCCAR176.9°123.9°
CAQNBICBCCAL59.1°0.1°
CAQNBICARCAP31.7°59.3°
NBICAQH1H2118.2°120.0°
NBICAQCAOH3153.1°178.3°
NBICAQCAOH487.4°61.6°
CAQNBICARH11152.0°60.7°
CAQNBICARH1288.6°179.3°
OAVCBFCANCBD179.4°179.9°
OAVCBFCANCBC179.7°180.0°
OAVCBFCBDNAU0.8°0.1°
OAVCBFCBDCAM179.4°179.7°
OAVCBFCANH130.3°0.1°
CBFOAVCABH14180.0°60.0°
CBFOAVCABH1560.0°60.0°
CBFOAVCABH1660.0°180.0°
CABOAVCBFCAN61.7°0.0°
CABOAVCBFCBD118.9°180.0°
OAVCABH14H15120.0°120.0°
OAVCABH14H16120.0°120.0°
OAVCABH15H16120.0°120.0°
CBFCANCBCH13180.0°179.9°
CANCBFCBDNAU179.8°180.0°
CANCBFCBDCAM1.2°0.2°
CBFCANCBCNBI180.0°180.0°
CBFCANCBCCAL0.5°0.3°
CBDCBFCANCBC0.9°0.0°
CBFCBDNAUCAM178.6°179.8°
CBFCBDCAMCAL1.0°0.2°
CBDCBFCANH13179.1°180.0°
CBFCBDCAMH18179.0°179.8°
CBFCBDNAUH1958.9°8.7°
CANCBCNBICAL179.5°179.8°
CANCBCNBICAR62.6°56.4°
CANCBCCALCAM0.3°0.3°
CANCBCCALH17179.6°179.7°
NAUCBDCAMCAL179.5°180.0°
NAUCBDCAMH180.5°0.0°
CBDCAMCALCBC0.6°0.0°
CBDCAMCALH18180.0°180.0°
CBDCAMCALH17179.4°180.0°
CAMCBDNAUH19119.6°171.1°
NBICBCCALCAM179.9°180.0°
CBCNBICARCAP151.5°176.8°
CBCNBICAQH142.0°56.8°
CBCNBICAQH276.8°63.2°
CBCNBICARH1131.2°63.3°
CBCNBICARH1288.2°56.7°
NBICBCCANH130.0°0.0°
NBICBCCALH170.1°0.0°
CALCBCNBICAR117.8°123.8°
CBCCALCAMH17180.0°180.0°
CALCBCCANH13179.5°179.8°
CBCCALCAMH18179.4°180.0°
NBICARCAPNBH53.9°58.4°
NBICARCAPH11120.2°120.0°
NBICARCAPH12120.3°120.1°
CARNBICAQH1141.2°179.3°
CARNBICAQH2100.0°60.7°
NBICARCAPH9173.2°178.3°
NBICARCAPH1065.5°61.6°
NBICARH11H12119.1°120.1°
CACNBHCAPCAR163.1°176.8°
CACNBHCAOH355.1°56.8°
CACNBHCAOH464.5°63.2°
NBHCACH6H7120.0°120.0°
NBHCACH6H8120.0°120.0°
NBHCACH7H8120.0°120.0°
CACNBHCAPH943.7°56.9°
CACNBHCAPH1077.5°63.2°
NBHCAPCARH9119.3°119.9°
NBHCAPCARH10119.3°120.0°
CAPNBHCAOH3177.7°179.3°
CAPNBHCAOH458.1°60.7°
CAPNBHCACH655.9°63.8°
CAPNBHCACH7175.9°56.2°
CAPNBHCACH864.1°176.2°
NBHCAPH9H10121.9°120.1°
NBHCAPCARH11174.1°61.6°
NBHCAPCARH1266.4°178.4°
CARCAPH9H10121.9°120.1°
CAPCARH11H12119.2°120.0°
H1CAQCAOH386.3°61.6°
H1CAQCAOH433.3°58.4°
H2CAQCAOH332.5°58.4°
H2CAQCAOH4152.0°178.5°
H6CACH7H8120.0°120.0°
H9CAPCARH1166.5°58.3°
H9CAPCARH1252.9°61.6°
H10CAPCARH1154.8°178.4°
H10CAPCARH12174.3°58.5°
H14CABH15H16120.0°120.0°
H17CALCAMH180.6°0.0°
H22CAKCAIH230.0°0.0°
H24CAJCAHH250.5°0.1°
H27CAGCAAH2958.5°180.0°
H27CAGCAAH3061.6°60.0°
H27CAGCAAH31178.4°60.0°
H28CAGCAAH2958.4°60.1°
H28CAGCAAH30178.4°179.9°
H28CAGCAAH3161.6°59.9°
H29CAAH30H31120.0°119.9°

222415

PDB entries from 2024-07-10

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