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4UW

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C36O35sing1.43Å1.43Å
O3PPdoub1.48Å1.50Å
O34CARdoub1.22Å1.23Å
O35CADsing1.36Å1.38Å
CAJCADdoub1.35Å1.39Å
CAJCAKsing1.46Å1.39Å
CADCACsing1.42Å1.39Å
N6C6sing1.38Å1.35Å
CAPCAKsing1.47Å1.48Å
CAPCAQdoub1.35Å1.33Å
N1C6doub1.33Å1.35ÅAromatic
N1C2sing1.32Å1.34ÅAromatic
CAKCAHdoub1.35Å1.40Å
CARCAQsing1.46Å1.48Å
CARO2Psing1.35Å1.45Å
C6C5sing1.41Å1.40ÅAromatic
CACOBFdoub1.21Å1.27Å
CACCASsing1.51Å1.40Å
C2N3doub1.32Å1.34ÅAromatic
CAHCASsing1.51Å1.40Å
C5N7sing1.35Å1.36ÅAromatic
C5C4doub1.40Å1.39ÅAromatic
N3C4sing1.33Å1.36ÅAromatic
N7C8doub1.30Å1.36ÅAromatic
C4N9sing1.37Å1.34ÅAromatic
O4'C1'sing1.44Å1.44Å
O4'C4'sing1.44Å1.43Å
PO2Psing1.61Å1.61Å
PO5'sing1.61Å1.60Å
PO1Psing1.61Å1.50Å
C8N9sing1.36Å1.34ÅAromatic
N9C1'sing1.46Å1.49Å
O5'C5'sing1.43Å1.43Å
C1'C2'sing1.55Å1.52Å
C4'C5'sing1.53Å1.51Å
C4'C3'sing1.54Å1.52Å
C2'O2'sing1.43Å1.44Å
C2'C3'sing1.55Å1.52Å
C3'O3'sing1.43Å1.44Å
C2H1sing1.08Å1.08Å
C8H2sing1.08Å1.08Å
O1PH3sing0.97Å0.95Å
CAQH4sing1.08Å1.08Å
CAPH5sing1.08Å1.08Å
CAHH6sing1.08Å1.08Å
CASH7sing1.09Å1.10Å
CASH8sing1.09Å1.10Å
C36H9sing1.09Å1.10Å
C36H10sing1.09Å1.10Å
C36H11sing1.09Å1.10Å
CAJH12sing1.08Å1.08Å
C5'H13sing1.09Å1.10Å
C5'H14sing1.09Å1.10Å
C4'H15sing1.09Å1.10Å
C1'H16sing1.09Å1.10Å
C2'H17sing1.09Å1.10Å
O2'H18sing0.97Å0.95Å
C3'H19sing1.09Å1.10Å
O3'H20sing0.97Å0.95Å
N6H21sing0.97Å1.00Å
N6H22sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C36O35CAD121.6°117.0°
O35C36H9109.5°109.5°
O35C36H10109.5°109.4°
O35C36H11109.5°109.4°
O3PPO2P110.7°109.4°
O3PPO5'108.7°109.5°
O3PPO1P120.2°109.5°
O34CARCAQ122.6°120.1°
O34CARO2P120.0°120.0°
O35CADCAJ119.2°119.5°
O35CADCAC120.4°119.4°
CADCAJCAK120.5°122.6°
CAJCADCAC120.4°121.1°
CADCAJH12119.7°118.7°
CAJCAKCAP118.0°119.4°
CAJCAKCAH119.3°121.3°
CAKCAJH12119.7°118.7°
CADCACOBF119.8°120.7°
CADCACCAS119.6°118.5°
N6C6N1117.7°120.7°
N6C6C5122.7°120.8°
C6N6H21109.5°120.0°
C6N6H22109.4°120.0°
CAKCAPCAQ122.9°120.0°
CAPCAKCAH122.7°119.4°
CAKCAPH5118.6°120.0°
CAPCAQCAR121.1°120.0°
CAPCAQH4119.5°119.9°
CAQCAPH5118.6°119.9°
C6N1C2121.3°121.2°
N1C6C5119.5°118.5°
N1C2N3120.8°122.4°
N1C2H1119.6°118.8°
CAKCAHCAS119.9°118.7°
CAKCAHH6120.0°120.6°
CAQCARO2P117.4°120.0°
CARCAQH4119.5°120.1°
CARO2PP124.8°114.0°
C6C5N7135.3°134.7°
C6C5C4117.8°118.1°
OBFCACCAS120.7°120.8°
CACCASCAH120.2°117.8°
CACCASH7106.7°107.8°
CACCASH8106.7°107.8°
C2N3C4120.2°120.6°
N3C2H1119.6°118.8°
CASCAHH6120.0°120.7°
CAHCASH7106.7°107.7°
CAHCASH8106.7°107.8°
N7C5C4106.9°107.1°
C5N7C8107.4°109.5°
C5C4N3120.3°119.1°
C5C4N9108.2°106.0°
N3C4N9131.5°134.9°
N7C8N9109.1°109.9°
N7C8H2125.4°125.0°
C4N9C8108.4°107.5°
C4N9C1'124.5°126.3°
C1'O4'C4'109.0°105.3°
O4'C1'N9108.8°110.4°
O4'C1'C2'106.5°104.8°
O4'C1'H16111.2°110.4°
O4'C4'C5'112.4°110.4°
O4'C4'C3'104.3°104.8°
O4'C4'H15110.4°110.4°
O2PPO5'104.0°109.5°
O2PPO1P102.8°109.5°
O5'PO1P109.2°109.5°
PO5'C5'120.2°123.0°
PO1PH3109.5°113.9°
C8N9C1'127.0°126.3°
N9C8H2125.4°125.0°
N9C1'C2'109.9°110.4°
N9C1'H16110.4°110.4°
O5'C5'C4'109.3°109.5°
O5'C5'H13109.5°109.4°
O5'C5'H14109.5°109.4°
C1'C2'O2'108.5°110.5°
C1'C2'C3'102.3°104.1°
C2'C1'H16110.0°110.4°
C1'C2'H17111.4°110.5°
C5'C4'C3'111.2°110.4°
C4'C5'H13109.5°109.5°
C4'C5'H14109.5°109.5°
C5'C4'H15109.2°110.3°
C4'C3'C2'100.8°104.1°
C4'C3'O3'113.4°110.5°
C3'C4'H15109.2°110.3°
C4'C3'H19108.8°110.5°
O2'C2'C3'109.8°110.5°
O2'C2'H17112.8°110.5°
C2'O2'H18109.5°114.0°
C2'C3'O3'114.5°110.5°
C3'C2'H17111.5°110.7°
C2'C3'H19108.8°110.5°
O3'C3'H19110.0°110.6°
C3'O3'H20109.5°114.0°
H7CASH8109.4°107.6°
H9C36H10109.4°109.5°
H9C36H11109.5°109.5°
H10C36H11109.5°109.5°
H13C5'H14109.5°109.5°
H21N6H22109.5°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C36O35CADCAJ106.4°0.3°
C36O35CADCAC74.5°180.0°
O35C36H9H10120.0°120.0°
O35C36H9H11120.0°119.9°
O35C36H10H11120.0°119.9°
O3PPO2PCAR58.3°55.1°
O3PPO2PO5'116.6°120.0°
O3PPO2PO1P129.6°120.0°
O3PPO5'O1P132.9°120.0°
O3PPO5'C5'166.4°55.0°
O3PPO1PH30.0°180.0°
O34CARCAQCAP27.5°0.1°
O34CARCAQO2P179.5°179.9°
O34CARO2PP13.6°0.1°
O34CARCAQH4152.5°180.0°
O35CADCAJCAC179.1°179.8°
O35CADCAJCAK179.5°179.7°
O35CADCACOBF0.9°0.1°
O35CADCACCAS179.2°180.0°
CADO35C36H9180.0°60.0°
CADO35C36H1060.0°180.0°
CADO35C36H1160.0°60.0°
O35CADCAJH120.5°0.3°
CADCAJCAKH12180.0°179.4°
CADCAJCAKCAP179.2°179.7°
CADCAJCAKCAH0.7°0.5°
CAJCADCACOBF179.9°179.7°
CAJCADCACCAS0.1°0.3°
CAKCAJCADCAC0.4°0.6°
CAJCAKCAPCAH179.9°179.8°
CAJCAKCAPCAQ178.4°0.3°
CAJCAKCAHCAS0.6°0.2°
CAJCAKCAPH51.6°179.8°
CAJCAKCAHH6179.3°179.8°
CADCACOBFCAS180.0°180.0°
CADCACCASCAH0.1°0.0°
CADCACCASH7121.6°122.1°
CADCACCASH8121.4°122.0°
CACCADCAJH12179.6°180.0°
N6C6N1C5179.6°179.9°
N6C6N1C2179.4°180.0°
N6C6C5N70.6°0.1°
N6C6C5C4179.0°179.9°
C6N6H21H22120.0°179.9°
CAKCAPCAQH5180.0°180.0°
CAKCAPCAQCAR179.2°180.0°
CAPCAKCAHCAS179.2°180.0°
CAKCAPCAQH40.8°0.0°
CAPCAKCAHH60.8°0.0°
CAPCAKCAJH120.8°0.2°
CAQCAPCAKCAH1.7°179.9°
CAPCAQCARH4180.0°179.9°
CAPCAQCARO2P153.0°180.0°
C6N1C2N30.2°0.0°
N1C6C5N7179.9°180.0°
N1C6C5C40.6°0.0°
C6N1C2H1179.8°180.0°
N1C6N6H210.0°0.0°
N1C6N6H22120.0°180.0°
C2N1C6C50.1°0.0°
N1C2N3H1180.0°180.0°
N1C2N3C40.1°0.0°
CAKCAHCASCAC0.3°0.0°
CAKCAHCASH6180.0°180.0°
CAHCAKCAPH5178.3°0.0°
CAKCAHCASH7121.9°122.2°
CAKCAHCASH8121.2°122.0°
CAHCAKCAJH12179.3°180.0°
CAQCARO2PP165.9°180.0°
CARCAQCAPH50.8°0.1°
CARO2PPO5'58.2°175.0°
CARO2PPO1P172.1°65.0°
O2PCARCAQH427.0°0.1°
C6C5N7C4179.6°180.0°
C6C5C4N30.6°0.0°
C6C5N7C8179.7°180.0°
C6C5C4N9180.0°179.9°
C5C6N6H21179.6°180.0°
C5C6N6H2259.5°0.1°
OBFCACCASCAH180.0°180.0°
OBFCACCASH758.4°57.9°
OBFCACCASH858.5°57.9°
CACCASCAHH7121.5°122.1°
CACCASCAHH8121.5°122.1°
CACCASCAHH6179.6°180.0°
CACCASH7H8115.1°116.0°
C2N3C4C50.3°0.0°
C2N3C4N9179.5°179.9°
CAHCASH7H8115.1°115.9°
N7C5C4N3179.7°180.0°
N7C5C4N90.3°0.1°
C5N7C8N90.2°0.0°
C5N7C8H2179.8°180.0°
C5C4N3N9179.2°179.9°
C4C5N7C80.1°0.0°
C5C4N9C80.4°0.1°
C5C4N9C1'179.7°180.0°
N3C4N9C8179.7°180.0°
N3C4N9C1'0.4°0.1°
C4N3C2H1179.9°180.0°
N7C8N9C40.4°0.1°
N7C8N9H2180.0°180.0°
N7C8N9C1'179.7°180.0°
C4N9C1'O4'160.6°156.5°
C4N9C8C1'179.9°179.9°
C4N9C1'C2'83.2°88.1°
C4N9C8H2179.6°180.0°
C4N9C1'H1638.3°34.2°
O4'C1'N9C819.3°23.6°
O4'C1'N9C2'116.2°115.4°
O4'C1'N9H16122.3°122.3°
O4'C1'C2'H16120.6°118.8°
C1'O4'C4'C5'146.8°159.3°
C1'O4'C4'C3'26.3°40.5°
O4'C1'C2'O2'92.4°142.6°
O4'C1'C2'C3'23.6°24.0°
C1'O4'C4'H1590.9°78.4°
O4'C1'C2'H17142.8°94.8°
C4'O4'C1'N9120.0°159.3°
O4'C4'C5'O5'59.1°69.6°
C4'O4'C1'C2'1.5°40.5°
O4'C4'C5'C3'116.5°115.4°
O4'C4'C5'H15122.9°122.3°
O4'C4'C3'H15118.0°118.9°
O4'C4'C3'C2'40.0°23.9°
O4'C4'C3'O3'162.9°142.6°
O4'C4'C5'H1360.9°50.4°
O4'C4'C5'H14179.1°170.4°
C4'O4'C1'H16118.3°78.4°
O4'C4'C3'H1974.3°94.7°
O2PPO5'O1P109.1°120.0°
O2PPO5'C5'48.5°175.0°
O2PPO1PH3123.5°60.0°
PO5'C5'C4'171.4°180.0°
O5'PO1PH3126.6°60.0°
PO5'C5'H1351.4°60.0°
PO5'C5'H1468.6°60.0°
O1PPO5'C5'60.7°65.0°
C8N9C1'C2'96.9°91.8°
C8N9C1'H16141.6°145.9°
N9C1'C2'H16121.7°122.3°
N9C1'C2'O2'149.9°98.5°
N9C1'C2'C3'94.0°142.8°
C1'N9C8H20.3°0.0°
N9C1'C2'H1725.2°24.0°
O5'C5'C4'H13120.0°120.0°
O5'C5'C4'H14120.0°120.0°
O5'C5'C4'C3'175.6°175.0°
O5'C5'H13H14120.1°120.0°
O5'C5'C4'H1563.8°52.7°
C1'C2'C3'C4'38.0°0.0°
C1'C2'O2'C3'111.1°114.6°
C1'C2'O2'H17124.0°122.6°
C1'C2'C3'H17119.2°118.7°
C1'C2'C3'O3'160.1°118.6°
C1'C2'O2'H18180.0°180.0°
C1'C2'C3'H1976.3°118.6°
C5'C4'C3'H15120.6°122.2°
C5'C4'C3'C2'161.4°142.8°
C5'C4'C3'O3'75.7°98.5°
C4'C5'H13H14120.1°120.0°
C5'C4'C3'H1947.0°24.2°
C4'C3'C2'O2'77.1°118.7°
C4'C3'C2'O3'122.1°118.7°
C4'C3'C2'H19114.3°118.6°
C4'C3'O3'H19122.1°122.7°
C3'C4'C5'H1355.6°65.0°
C3'C4'C5'H1464.4°55.0°
C4'C3'C2'H17157.2°118.7°
C4'C3'O3'H20180.0°180.0°
O2'C2'C3'H17125.7°122.7°
O2'C2'C3'O3'45.0°0.0°
O2'C2'C1'H1628.2°23.8°
O2'C2'C3'H19168.6°122.7°
C2'C3'O3'H19122.9°122.7°
C2'C3'C4'H1578.0°95.0°
C3'C2'C1'H16144.2°94.8°
C3'C2'O2'H1868.9°65.4°
C2'C3'O3'H2065.1°65.4°
O3'C3'C4'H1544.9°23.7°
O3'C3'C2'H1780.7°122.7°
H4CAQCAPH5179.2°180.0°
H6CAHCASH758.1°57.9°
H6CAHCASH858.8°58.0°
H9C36H10H11120.0°120.1°
H13C5'C4'H15176.2°172.7°
H14C5'C4'H1556.1°67.2°
H15C4'C3'H19167.6°146.4°
H16C1'C2'H1796.5°146.4°
H17C2'O2'H1856.1°57.4°
H17C2'C3'H1942.9°0.1°
H19C3'O3'H2057.9°57.3°

224931

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