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58O

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CANCALsing1.53Å1.55Å
CANNBHsing1.47Å1.49Å
CALCBGsing1.53Å1.50Å
CAPNBHsing1.47Å1.52Å
CAPCAZsing1.51Å1.49Å
OAVCAAsing1.43Å1.43Å
OAVCBAsing1.36Å1.36Å
NBHCAOsing1.47Å1.52Å
FAECBIsing1.40Å1.30Å
CAZCBAdoub1.39Å1.40ÅAromatic
CAZCAIsing1.36Å1.42ÅAromatic
CBACAKsing1.38Å1.42ÅAromatic
CBGNATsing1.46Å1.50Å
CBGCAMsing1.53Å1.50Å
N1C2doub1.32Å1.39ÅAromatic
N1C6sing1.33Å1.35ÅAromatic
NATC6sing1.38Å1.36Å
CAICBCdoub1.40Å1.33ÅAromatic
C2N3sing1.31Å1.38ÅAromatic
FADCBIsing1.40Å1.32Å
C6C5doub1.42Å1.40ÅAromatic
CAKCBDdoub1.39Å1.35ÅAromatic
CAOCAMsing1.53Å1.54Å
CBIFACsing1.40Å1.29Å
CBICAQsing1.53Å1.54Å
N3C4doub1.34Å1.36ÅAromatic
C5C4sing1.40Å1.38ÅAromatic
C5CAJsing1.45Å1.37ÅAromatic
C4SAWsing1.76Å1.69ÅAromatic
CBCCBDsing1.41Å1.36ÅAromatic
CBCCAHsing1.42Å1.37ÅAromatic
CAJCAYdoub1.32Å1.38ÅAromatic
CBDNAUsing1.38Å1.34ÅAromatic
CAYSAWsing1.75Å1.65ÅAromatic
CAYCAQsing1.51Å1.50Å
CAHCAXdoub1.36Å1.34ÅAromatic
NAUCAXsing1.38Å1.34ÅAromatic
CAXCAFsing1.43Å1.49Å
CAFNABtrip1.14Å1.10Å
CAQH1sing1.09Å1.10Å
CAQH2sing1.09Å1.10Å
CAJH3sing1.08Å1.08Å
C2H4sing1.08Å1.08Å
NATH5sing0.97Å1.00Å
CBGH6sing1.09Å1.10Å
CAMH7sing1.09Å1.10Å
CAMH8sing1.09Å1.10Å
CAOH9sing1.09Å1.10Å
CAOH10sing1.09Å1.10Å
CALH11sing1.09Å1.10Å
CALH12sing1.09Å1.10Å
CANH13sing1.09Å1.10Å
CANH14sing1.09Å1.10Å
CAPH16sing1.09Å1.10Å
CAPH17sing1.09Å1.10Å
CAIH18sing1.08Å1.08Å
CAHH19sing1.08Å1.08Å
NAUH20sing0.97Å1.00Å
CAKH21sing1.08Å1.08Å
CAAH22sing1.09Å1.10Å
CAAH23sing1.09Å1.10Å
CAAH24sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CALCANNBH113.2°109.5°
CANCALCBG110.5°109.3°
CANCALH11109.2°109.5°
CANCALH12109.2°109.5°
CALCANH13108.5°109.5°
CALCANH14108.6°109.5°
CANNBHCAP106.9°111.0°
CANNBHCAO108.5°111.2°
NBHCANH13108.6°109.4°
NBHCANH14108.6°109.4°
CALCBGNAT110.6°109.6°
CALCBGCAM111.6°109.2°
CALCBGH6110.0°109.6°
CBGCALH11109.2°109.5°
CBGCALH12109.2°109.5°
NBHCAPCAZ114.7°109.5°
CAPNBHCAO110.4°111.0°
NBHCAPH16108.1°109.5°
NBHCAPH17108.1°109.4°
CAPCAZCBA123.5°119.7°
CAPCAZCAI122.0°119.8°
CAZCAPH16108.1°109.5°
CAZCAPH17108.1°109.5°
CAAOAVCBA120.3°117.0°
OAVCAAH22109.5°109.5°
OAVCAAH23109.5°109.5°
OAVCAAH24109.5°109.5°
OAVCBACAZ114.1°119.7°
OAVCBACAK124.7°119.7°
NBHCAOCAM104.9°109.5°
NBHCAOH9110.6°109.4°
NBHCAOH10110.6°109.4°
FAECBIFAD107.8°109.4°
FAECBIFAC109.2°109.5°
FAECBICAQ110.2°109.5°
CBACAZCAI114.4°120.5°
CAZCBACAK121.2°120.5°
CAZCAICBC123.7°119.9°
CAZCAIH18118.1°120.0°
CBACAKCBD119.6°119.7°
CBACAKH21120.2°120.1°
NATCBGCAM104.5°109.5°
CBGNATC6124.3°120.0°
CBGNATH5105.6°120.0°
NATCBGH6110.0°109.6°
CBGCAMCAO110.4°109.3°
CAMCBGH6110.0°109.5°
CBGCAMH7109.2°109.5°
CBGCAMH8109.2°109.5°
C2N1C6121.4°121.2°
N1C2N3118.5°122.2°
N1C2H4120.8°118.9°
N1C6NAT118.7°120.5°
N1C6C5120.9°118.9°
NATC6C5120.3°120.5°
C6NATH5105.7°120.0°
CAICBCCBD120.7°119.8°
CAICBCCAH131.5°133.3°
CBCCAIH18118.1°120.1°
C2N3C4119.4°121.0°
N3C2H4120.7°118.9°
FADCBIFAC108.7°109.5°
FADCBICAQ111.7°109.5°
C6C5C4116.5°117.5°
C6C5CAJ132.5°130.5°
CAKCBDCBC120.4°119.5°
CAKCBDNAU131.6°133.1°
CBDCAKH21120.2°120.2°
CAOCAMH7109.2°109.5°
CAOCAMH8109.3°109.5°
CAMCAOH9110.6°109.4°
CAMCAOH10110.6°109.5°
FACCBICAQ109.2°109.5°
CBICAQCAY109.6°109.4°
CBICAQH1109.5°109.5°
CBICAQH2109.4°109.4°
N3C4C5123.2°119.1°
N3C4SAW126.6°131.3°
C4C5CAJ111.0°112.0°
C5C4SAW110.2°109.6°
C5CAJCAY115.4°114.8°
C5CAJH3122.3°122.6°
C4SAWCAY94.6°92.2°
CBDCBCCAH107.8°107.0°
CBCCBDNAU108.0°107.4°
CBCCAHCAX106.3°107.8°
CBCCAHH19126.9°126.1°
CAJCAYSAW108.7°111.4°
CAJCAYCAQ124.8°124.3°
CAYCAJH3122.3°122.6°
CBDNAUCAX107.6°108.8°
CBDNAUH20126.2°125.7°
SAWCAYCAQ126.4°124.3°
CAYCAQH1109.5°109.5°
CAYCAQH2109.4°109.5°
CAHCAXNAU110.3°109.1°
CAHCAXCAF130.6°125.4°
CAXCAHH19126.9°126.1°
NAUCAXCAF119.1°125.5°
CAXNAUH20126.2°125.6°
CAXCAFNAB179.5°179.9°
H1CAQH2109.5°109.5°
H7CAMH8109.5°109.5°
H9CAOH10109.5°109.5°
H11CALH12109.5°109.5°
H13CANH14109.4°109.5°
H16CAPH17109.5°109.5°
H22CAAH23109.4°109.5°
H22CAAH24109.5°109.5°
H23CAAH24109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CALCANNBHH13120.6°120.0°
CALCANNBHH14120.6°120.1°
CANCALCBGH11120.2°120.0°
CANCALCBGH12120.1°120.0°
CALCANNBHCAP178.4°174.1°
CALCANNBHCAO59.3°61.7°
CANCALCBGNAT165.1°177.6°
CANCALCBGCAM49.2°57.7°
CANCALCBGH673.2°62.2°
CANCALH11H12119.6°120.1°
CALCANH13H14118.3°120.1°
NBHCANCALCBG50.1°59.2°
CANNBHCAPCAO117.9°124.2°
CANNBHCAPCAZ172.7°170.0°
CANNBHCAOCAM65.2°61.7°
CANNBHCAOH9175.6°58.3°
CANNBHCAOH1054.1°178.3°
NBHCANCALH11170.3°60.8°
NBHCANCALH1270.0°179.2°
NBHCANH13H14118.3°119.9°
CANNBHCAPH1651.9°50.0°
CANNBHCAPH1766.6°70.0°
CALCBGNATCAM120.2°119.7°
CALCBGNATH6121.7°120.2°
CALCBGCAMH6122.4°119.9°
CALCBGNATC6109.3°85.3°
CALCBGCAMCAO59.9°57.6°
CALCBGNATH512.8°94.6°
CALCBGCAMH7180.0°177.5°
CALCBGCAMH860.3°62.3°
CBGCALH11H12119.5°120.1°
CBGCALCANH13170.7°179.1°
CBGCALCANH1470.5°60.8°
NBHCAPCAZH16120.8°120.0°
NBHCAPCAZH17120.7°120.0°
NBHCAPCAZCBA62.2°80.0°
NBHCAPCAZCAI121.6°99.7°
CAPNBHCAOCAM178.0°174.1°
CAPNBHCAOH958.7°65.9°
CAPNBHCAOH1062.7°54.1°
CAPNBHCANH1361.1°54.1°
CAPNBHCANH1457.8°65.8°
NBHCAPH16H17117.6°120.0°
CAPCAZCBAOAV2.8°0.1°
CAZCAPNBHCAO69.5°65.7°
CAPCAZCBACAI176.5°179.7°
CAPCAZCBACAK178.0°179.7°
CAPCAZCAICBC177.8°180.0°
CAZCAPH16H17117.6°120.0°
CAPCAZCAIH182.2°0.0°
CAAOAVCBACAZ173.8°180.0°
CAAOAVCBACAK5.4°0.3°
OAVCAAH22H23120.0°120.0°
OAVCAAH22H24120.0°120.1°
OAVCAAH23H24120.0°120.0°
OAVCBACAZCAK179.2°179.6°
OAVCBACAZCAI179.2°179.8°
OAVCBACAKCBD179.7°179.7°
OAVCBACAKH210.3°0.1°
CBAOAVCAAH22180.0°180.0°
CBAOAVCAAH2360.0°60.0°
CBAOAVCAAH2460.0°59.9°
NBHCAOCAMCBG66.4°59.1°
NBHCAOCAMH9119.3°120.0°
NBHCAOCAMH10119.3°120.0°
NBHCAOCAMH7173.4°179.1°
NBHCAOCAMH853.7°60.8°
NBHCAOH9H10122.1°120.0°
CAONBHCANH13179.8°178.3°
CAONBHCANH1461.3°58.3°
CAONBHCAPH16169.8°174.2°
CAONBHCAPH1751.3°54.2°
FAECBIFADFAC118.2°120.0°
FAECBIFADCAQ121.2°120.0°
FAECBIFACCAQ120.6°120.0°
FAECBICAQCAY58.5°180.0°
FAECBICAQH1178.5°60.0°
FAECBICAQH261.5°60.0°
CBACAZCAICBC1.3°0.2°
CAZCBACAKCBD0.5°0.7°
CBACAZCAPH1658.6°40.0°
CBACAZCAPH17177.1°160.0°
CBACAZCAIH18178.7°179.7°
CAZCBACAKH21179.5°179.7°
CAICAZCBACAK1.5°0.6°
CAZCAICBCH18180.0°179.9°
CAZCAICBCCBD0.1°0.0°
CAZCAICBCCAH179.8°180.0°
CAICAZCAPH16117.6°140.2°
CAICAZCAPH170.9°20.2°
CBACAKCBDH21180.0°179.6°
CBACAKCBDCBC0.9°0.4°
CBACAKCBDNAU178.9°179.8°
NATCBGCAMH6118.0°120.1°
CBGNATC6N12.8°0.1°
CBGNATC6H5122.0°179.9°
CBGNATC6C5179.9°180.0°
NATCBGCAMCAO179.4°177.6°
NATCBGCAMH760.5°62.5°
NATCBGCAMH859.2°57.6°
NATCBGCALH1174.8°57.6°
NATCBGCALH1244.9°62.4°
CAMCBGNATC6130.5°155.0°
CBGCAMCAOH7120.1°120.0°
CBGCAMCAOH8120.1°120.0°
CAMCBGNATH5107.4°25.0°
CBGCAMH7H8119.5°120.1°
CBGCAMCAOH9174.3°60.8°
CBGCAMCAOH1052.8°179.2°
CAMCBGCALH11169.4°62.3°
CAMCBGCALH1270.9°177.7°
C2N1C6NAT179.7°179.9°
N1C2N3H4180.0°179.8°
C2N1C6C53.2°0.0°
N1C2N3C41.1°0.5°
N1C6NATC5177.1°179.9°
C6N1C2N32.3°0.2°
N1C6C5C42.8°0.0°
N1C6C5CAJ177.5°179.9°
C6N1C2H4177.7°180.0°
N1C6NATH5119.2°180.0°
NATC6C5C4179.9°179.9°
NATC6C5CAJ0.5°0.0°
C6NATCBGH612.5°34.9°
CAICBCCBDCAK1.2°0.1°
CAICBCCBDCAH179.7°180.0°
CAICBCCBDNAU179.7°179.9°
CAICBCCAHCAX180.0°180.0°
CAICBCCAHH190.0°0.0°
C2N3C4C50.9°0.5°
C2N3C4SAW178.7°179.9°
FADCBIFACCAQ122.0°120.0°
FADCBICAQCAY61.3°60.0°
FADCBICAQH158.7°59.9°
FADCBICAQH2178.7°179.9°
C6C5C4N31.7°0.2°
C6C5C4CAJ179.7°180.0°
C6C5C4SAW177.9°180.0°
C6C5CAJCAY179.6°180.0°
C6C5CAJH30.4°0.1°
C5C6NATH557.9°0.1°
CAKCBDCBCNAU178.5°179.9°
CAKCBDCBCCAH179.0°179.9°
CAKCBDNAUCAX178.9°179.9°
CAKCBDNAUH201.1°0.2°
CAOCAMCBGH662.6°62.3°
CAOCAMH7H8119.6°120.1°
CAMCAOH9H10122.2°120.0°
FACCBICAQCAY178.5°60.0°
FACCBICAQH161.5°180.0°
FACCBICAQH258.5°60.0°
CBICAQCAYCAJ103.7°90.0°
CBICAQCAYSAW79.2°90.0°
CBICAQCAYH1120.0°120.0°
CBICAQCAYH2120.0°120.0°
CBICAQH1H2119.9°119.9°
N3C4C5SAW179.6°179.7°
N3C4C5CAJ178.6°179.7°
N3C4SAWCAY177.3°179.7°
C4N3C2H4178.9°179.8°
C4C5CAJCAY0.7°0.0°
C5C4SAWCAY3.0°0.0°
C4C5CAJH3179.3°180.0°
CAJC5C4SAW1.8°0.0°
C5CAJCAYH3180.0°179.9°
C5CAJCAYSAW2.9°0.0°
C5CAJCAYCAQ179.5°179.9°
C4SAWCAYCAJ3.3°0.0°
C4SAWCAYCAQ179.1°180.0°
CBDCBCCAHCAX0.3°0.0°
CBCCBDNAUCAX0.7°0.1°
CBDCBCCAIH18179.9°180.0°
CBDCBCCAHH19179.7°180.0°
CBCCBDNAUH20179.3°180.0°
CBCCBDCAKH21179.1°180.0°
CAHCBCCBDNAU0.6°0.1°
CBCCAHCAXH19180.0°180.0°
CBCCAHCAXNAU0.2°0.0°
CBCCAHCAXCAF179.8°180.0°
CAHCBCCAIH180.2°0.0°
CAJCAYSAWCAQ177.5°180.0°
CAJCAYCAQH1136.3°29.9°
CAJCAYCAQH216.3°150.0°
CBDNAUCAXCAH0.5°0.1°
CBDNAUCAXH20180.0°179.9°
CBDNAUCAXCAF179.8°180.0°
NAUCBDCAKH211.1°0.1°
SAWCAYCAQH140.8°150.0°
SAWCAYCAQH2160.8°30.0°
SAWCAYCAJH3177.1°180.0°
CAYCAQH1H2120.0°120.1°
CAQCAYCAJH30.5°0.0°
CAHCAXNAUCAF179.7°180.0°
CAHCAXCAFNAB10.9°107.2°
CAHCAXNAUH20179.4°180.0°
NAUCAXCAFNAB168.7°72.8°
NAUCAXCAHH19179.8°180.0°
CAFCAXCAHH190.2°0.0°
CAFCAXNAUH200.2°0.1°
H5NATCBGH6134.5°145.1°
H6CBGCAMH757.6°57.6°
H6CBGCAMH8177.3°177.7°
H6CBGCALH1146.9°177.8°
H6CBGCALH12166.6°57.8°
H7CAMCAOH954.2°59.1°
H7CAMCAOH1067.3°60.9°
H8CAMCAOH965.6°179.2°
H8CAMCAOH10172.9°59.2°
H11CALCANH1369.2°59.1°
H11CALCANH1449.7°179.2°
H12CALCANH1350.5°60.9°
H12CALCANH14169.4°59.2°
H22CAAH23H24120.0°120.0°

248942

PDB entries from 2026-02-11

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