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Q3Q

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1C2sing1.54Å1.54Å
C1C4sing1.54Å1.54Å
C6S8sing1.83Å1.83Å
C6C2sing1.52Å1.52Å
O9S8doub1.51Å1.51Å
C3B19sing1.69Å1.69Å
C3B10sing1.67Å1.67Å
S8O5doub1.48Å1.48Å
S8N1sing1.60Å1.60Å
C4C7sing1.53Å1.53Å
C7B15sing1.64Å1.64Å
C7B14sing1.71Å1.71Å
C7B13sing1.71Å1.71Å
B15B16sing1.77Å1.77Å
B15B17sing1.77Å1.77Å
B16B19sing1.78Å1.78Å
B16B11sing1.76Å1.76Å
B19B14sing1.77Å1.77Å
B19B11sing1.77Å1.77Å
B10B12sing1.75Å1.75Å
B11B17sing1.79Å1.79Å
B17B13sing1.79Å1.79Å
B13B18sing1.76Å1.76Å
B18B12sing1.74Å1.74Å
C1H1sing1.10Å1.10Å
C1H2sing1.10Å1.10Å
C6H3sing1.10Å1.10Å
C6H4sing1.10Å1.10Å
N1H7sing1.00Å1.00Å
N1H8sing1.00Å1.00Å
C2H9sing1.10Å1.10Å
C2H10sing1.10Å1.10Å
C4H11sing1.10Å1.10Å
C4H12sing1.10Å1.10Å
C3C7sing1.70Å1.70Å
B12B13sing1.84Å1.84Å
C3B12sing1.77Å1.77Å
C7B12sing1.75Å1.75Å
C3B14sing1.77Å1.77Å
B10B18sing1.80Å1.80Å
B17B18sing1.83Å1.83Å
B19B10sing1.80Å1.80Å
B11B18sing1.80Å1.80Å
B11B10sing1.81Å1.81Å
B16B14sing1.81Å1.81Å
B16B17sing1.80Å1.80Å
B15B13sing1.80Å1.80Å
B15B14sing1.82Å1.82Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C2C1C4113.0°113.0°
C1C2C6110.5°110.5°
C2C1H1108.6°108.6°
C2C1H2108.6°108.6°
C1C2H9109.2°109.2°
C1C2H10109.2°109.2°
C1C4C7121.5°121.5°
C4C1H1108.6°108.6°
C4C1H2108.6°108.6°
C1C4H11106.4°106.4°
C1C4H12106.4°106.4°
S8C6C2111.9°111.9°
C6S8O9105.5°105.5°
C6S8O5106.4°106.4°
C6S8N1105.2°105.2°
S8C6H3108.9°108.9°
S8C6H4108.9°108.9°
C2C6H3108.8°108.8°
C2C6H4108.9°108.9°
C6C2H9109.2°109.2°
C6C2H10109.2°109.2°
O9S8O5113.0°113.0°
O9S8N1112.4°112.4°
B19C3B1064.9°64.9°
C3B19B16107.8°107.8°
C3B19B1461.4°61.4°
C3B19B11105.1°105.1°
B19C3C7105.5°105.5°
B19C3B12113.8°113.8°
B19C3B1461.5°61.5°
C3B19B1057.2°57.2°
C3B10B1262.0°62.0°
B10C3C7107.5°107.5°
B10C3B1261.2°61.2°
B10C3B14115.8°115.8°
C3B10B18106.1°106.1°
C3B10B1957.9°57.9°
C3B10B11103.8°103.8°
O5S8N1113.4°113.4°
S8N1H7109.5°109.5°
S8N1H8109.5°109.5°
C4C7B15117.0°117.0°
C4C7B14110.5°110.5°
C4C7B13119.5°119.5°
C7C4H11106.4°106.4°
C7C4H12106.4°106.4°
C4C7C3115.7°115.7°
C4C7B12117.1°117.1°
B15C7B1466.0°66.0°
B15C7B1365.0°65.0°
C7B15B16104.0°104.0°
C7B15B17104.9°104.9°
B15C7C3115.3°115.3°
B15C7B12118.4°118.4°
C7B15B1359.4°59.4°
C7B15B1458.8°58.8°
B14C7B13121.2°121.2°
C7B14B19101.7°101.7°
B14C7C362.5°62.5°
B14C7B12117.5°117.5°
C7B14C358.4°58.4°
C7B14B1699.5°99.5°
C7B14B1555.2°55.2°
C7B13B17100.8°100.8°
C7B13B18101.3°101.3°
B13C7C3114.8°114.8°
C7B13B1259.1°59.1°
B13C7B1264.1°64.1°
C7B13B1555.5°55.5°
B16B15B1761.2°61.2°
B15B16B19107.3°107.3°
B15B16B11106.7°106.7°
B15B16B1461.2°61.2°
B15B16B1759.4°59.4°
B16B15B13109.5°109.5°
B16B15B1460.5°60.5°
B15B17B11105.2°105.2°
B15B17B1360.8°60.8°
B15B17B18105.6°105.6°
B15B17B1659.5°59.5°
B17B15B1360.3°60.3°
B17B15B14110.6°110.6°
B19B16B1159.9°59.9°
B16B19B1461.4°61.4°
B16B19B1159.5°59.5°
B16B19B10109.0°109.0°
B19B16B1459.1°59.1°
B19B16B17109.0°109.0°
B16B11B1960.6°60.6°
B16B11B1760.8°60.8°
B16B11B18109.4°109.4°
B16B11B10109.7°109.7°
B11B16B14107.6°107.6°
B11B16B1760.6°60.6°
B14B19B11109.1°109.1°
B19B14C357.1°57.1°
B14B19B10109.3°109.3°
B19B14B1659.5°59.5°
B19B14B15105.3°105.3°
B19B11B17109.7°109.7°
B11B19B1060.9°60.9°
B19B11B18108.6°108.6°
B19B11B1060.7°60.7°
B10B12B1862.1°62.1°
B10B12B13108.8°108.8°
B10B12C356.8°56.8°
B10B12C7101.7°101.7°
B12B10B1858.7°58.7°
B12B10B19108.9°108.9°
B12B10B11107.0°107.0°
B11B17B13106.6°106.6°
B11B17B1859.7°59.7°
B17B11B1861.1°61.1°
B17B11B10110.0°110.0°
B11B17B1658.6°58.6°
B17B13B1861.9°61.9°
B17B13B12107.7°107.7°
B13B17B1858.3°58.3°
B13B17B16108.5°108.5°
B17B13B1558.9°58.9°
B13B18B1263.3°63.3°
B18B13B1257.8°57.8°
B13B18B10110.0°110.0°
B13B18B1759.8°59.8°
B13B18B11107.4°107.4°
B18B13B15106.9°106.9°
B18B12B1358.9°58.9°
B18B12C3104.7°104.7°
B18B12C7100.5°100.5°
B12B18B1059.2°59.2°
B12B18B17110.5°110.5°
B12B18B11107.8°107.8°
H1C1H2109.5°109.5°
H3C6H4109.5°109.5°
H7N1H8109.5°109.5°
H9C2H10109.5°109.5°
H11C4H12109.5°109.5°
C7C3B1260.8°60.8°
C3C7B1261.6°61.6°
C7C3B1459.1°59.1°
B13B12C3105.5°105.5°
B13B12C756.8°56.8°
B12B13B15106.3°106.3°
C3B12C757.6°57.6°
B12C3B14113.8°113.8°
C3B14B16103.1°103.1°
C3B14B15103.5°103.5°
B10B18B17108.7°108.7°
B18B10B19106.8°106.8°
B10B18B1160.3°60.3°
B18B10B1159.9°59.9°
B17B18B1159.2°59.2°
B18B17B16106.5°106.5°
B19B10B1158.5°58.5°
B18B11B1059.9°59.9°
B14B16B17109.7°109.7°
B16B14B1558.2°58.2°
B13B15B14110.6°110.6°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C2C1C4H1120.5°120.5°
C2C1C4H2120.5°120.5°
C1C2C6S8109.5°109.5°
C1C2C6H9120.2°120.2°
C1C2C6H10120.2°120.2°
C2C1C4C7175.1°175.1°
C2C1H1H2118.3°118.4°
C1C2C6H310.9°10.9°
C1C2C6H4130.2°130.2°
C1C2H9H10119.5°119.5°
C2C1C4H1153.4°53.4°
C2C1C4H1263.2°63.2°
C4C1C2C668.6°68.6°
C1C4C7H11121.7°121.7°
C1C4C7H12121.7°121.7°
C1C4C7B1560.0°60.0°
C1C4C7B14132.6°132.6°
C1C4C7B1315.2°15.2°
C4C1H1H2118.4°118.4°
C4C1C2H9171.3°171.3°
C4C1C2H1051.6°51.6°
C1C4H11H12114.5°114.5°
C1C4C7C3158.9°158.9°
C1C4C7B1289.2°89.2°
S8C6C2H3120.4°120.4°
S8C6C2H4120.4°120.4°
C6S8O9O5115.9°115.9°
C6S8O9N1114.1°114.1°
C6S8O5N1115.2°115.2°
S8C6H3H4118.9°118.9°
C6S8N1H7180.0°180.0°
C6S8N1H860.0°60.0°
S8C6C2H910.7°10.7°
S8C6C2H10130.4°130.4°
C2C6S8O963.3°63.3°
C2C6S8O5176.4°176.4°
C2C6S8N155.7°55.7°
C6C2C1H1170.9°170.9°
C6C2C1H252.0°52.0°
C2C6H3H4118.9°118.9°
C6C2H9H10119.5°119.5°
O9S8O5N1129.4°129.4°
O9S8C6H357.0°57.0°
O9S8C6H4176.3°176.3°
O9S8N1H765.7°65.7°
O9S8N1H854.3°54.3°
B19C3B10C799.3°99.3°
B19C3B10B12140.1°140.1°
B19C3B10B1435.8°35.8°
B19C3C7C4142.8°142.8°
B19C3C7B151.0°1.0°
B19C3C7B1442.0°42.0°
B19C3C7B1371.8°71.8°
C3B19B16B152.3°2.3°
C3B19B16B1441.6°41.6°
C3B19B16B1197.4°97.4°
C3B19B16B1060.5°60.5°
C3B19B14B1197.1°97.1°
C3B19B11B1037.5°37.5°
C3B19B11B1764.8°64.8°
B19C3B12B181.9°1.9°
B19C3C7B12108.9°108.9°
B19C3B12B1363.1°63.1°
B19C3B12B1468.0°68.0°
B19C3B10B18100.1°100.1°
C3B19B11B180.3°0.3°
C3B19B16B1760.5°60.5°
C3B19B14B1596.4°96.4°
B10C3C7C4149.2°149.2°
B10C3C7B1569.0°69.0°
B10C3C7B14110.0°110.0°
B10C3C7B133.7°3.7°
C3B10B11B160.8°0.8°
C3B10B12B18133.7°133.7°
C3B10B12B1196.9°96.9°
C3B10B11B1764.3°64.3°
C3B10B18B132.3°2.3°
B10C3C7B1240.9°40.9°
B10C3B12B13102.6°102.6°
B10C3B12B14107.4°107.4°
C3B10B18B1196.9°96.9°
C3B10B18B1761.5°61.5°
B10C3B14B162.5°2.5°
B10C3B14B1562.5°62.5°
O5S8C6H363.3°63.3°
O5S8C6H456.0°56.0°
O5S8N1H764.1°64.1°
O5S8N1H8175.9°175.9°
N1S8C6H3176.1°176.1°
N1S8C6H464.7°64.7°
S8N1H7H8120.0°120.0°
C4C7B15B14101.7°101.7°
C4C7B15B13111.8°111.8°
C4C7B15C3141.2°141.2°
C4C7B15B12148.8°148.8°
C4C7B14B13147.1°147.1°
C4C7B14C3109.1°109.1°
C4C7B14B12137.9°137.9°
C4C7B13C3144.1°144.1°
C4C7B13B12107.9°107.9°
C4C7B15B16143.6°143.6°
C4C7B15B17153.0°153.0°
C4C7B14B19148.1°148.1°
C4C7B12B10143.6°143.6°
C4C7B13B17147.9°147.9°
C4C7B13B18149.0°149.0°
C4C7B12B18153.0°153.0°
C7C4C1H164.4°64.4°
C7C4C1H254.6°54.6°
C7C4H11H12114.6°114.6°
C4C7C3B12108.3°108.3°
C4C7B14B16151.3°151.3°
B15C7B14B1335.8°35.8°
B15C7B14C3139.5°139.5°
B15C7B14B12110.7°110.7°
B15C7B13C3107.7°107.7°
B15C7B13B12143.9°143.9°
C7B15B16B1799.5°99.5°
C7B15B16B1362.1°62.1°
C7B15B16B1441.1°41.1°
C7B15B17B1340.7°40.7°
C7B15B17B1461.8°61.8°
C7B15B16B192.8°2.8°
C7B15B16B1160.2°60.2°
C7B15B14B1993.8°93.8°
B15C7B12B1067.6°67.6°
C7B15B17B1160.0°60.0°
B15C7B13B18102.9°102.9°
B15C7B12B184.2°4.2°
B15C7C4H11178.4°178.4°
B15C7C4H1261.7°61.7°
B15C7C3B12109.9°109.9°
C7B15B17B182.2°2.2°
B14C7B13C371.7°71.7°
B14C7B13B12107.8°107.8°
C7B14B19B1694.3°94.3°
C7B14B16B1161.4°61.4°
C7B14B19B1157.5°57.5°
B14C7B12B108.5°8.5°
B14C7B13B173.6°3.6°
B14C7B13B1866.8°66.8°
B14C7B12B1871.8°71.8°
B14C7C4H11105.7°105.7°
B14C7C4H1211.0°11.0°
B14C7C3B12150.9°150.9°
C7B14C3B1693.3°93.3°
C7B14B19B107.4°7.4°
C7B14B16B172.9°2.9°
B13C7B14B1964.8°64.8°
C7B13B12B1091.9°91.9°
C7B13B17B1160.6°60.6°
C7B13B17B1897.1°97.1°
C7B13B17B1260.8°60.8°
C7B13B18B1241.8°41.8°
B13C7C4H11106.5°106.5°
B13C7C4H12136.8°136.8°
B13C7C3B1237.2°37.2°
C7B13B18B104.2°4.2°
C7B13B18B1159.8°59.8°
B13C7B14B164.2°4.2°
C7B13B17B161.2°1.2°
B16B15B17B13138.8°138.8°
B16B15B17B1436.2°36.2°
B15B16B19B1199.7°99.7°
B15B16B19B1439.3°39.3°
B15B16B19B1762.8°62.8°
B15B16B11B1464.4°64.4°
B15B16B11B1738.7°38.7°
B16B15B13B182.9°2.9°
B16B15C7C32.4°2.4°
B16B15B13B1263.4°63.4°
B16B15C7B1267.6°67.6°
B15B16B14C398.0°98.0°
B16B15B17B18100.2°100.2°
B15B16B19B1062.8°62.8°
B15B16B11B180.3°0.3°
B15B16B11B1063.7°63.7°
B16B15B13B1464.9°64.9°
B17B15B14B191.6°1.6°
B15B17B11B191.4°1.4°
B15B17B11B1363.5°63.5°
B15B17B11B1899.5°99.5°
B15B17B13B18135.1°135.1°
B15B17B18B120.3°0.3°
B17B15C7C365.8°65.8°
B15B17B13B1298.7°98.7°
B17B15C7B124.2°4.2°
B17B15B14C360.7°60.7°
B15B17B18B1063.0°63.0°
B15B17B11B1063.5°63.5°
B17B15B13B14102.6°102.6°
B19B16B11B1436.2°36.2°
B19B16B11B17139.4°139.4°
B16B19B14B10101.6°101.6°
B16B19B11B10139.5°139.5°
B16B19B10B1262.5°62.5°
B19B16B17B1361.9°61.9°
B16B19C3C70.9°0.9°
B16B19C3B1263.6°63.6°
B16B19B10B180.6°0.6°
B19B16B17B180.5°0.5°
B19B16B11B18100.9°100.9°
B19B16B14B17100.9°100.9°
B19B16B15B1364.9°64.9°
B16B11B10B1265.3°65.3°
B16B11B17B18137.9°137.9°
B16B11B17B10102.0°102.0°
B11B16B17B1398.5°98.5°
B16B11B18B131.5°1.5°
B16B11B18B1265.3°65.3°
B11B16B14C31.8°1.8°
B16B11B18B10102.0°102.0°
B11B16B14B1764.3°64.3°
B11B16B15B131.9°1.9°
B14B19B11B10101.9°101.9°
B14B19B10B122.9°2.9°
B14B19B11B170.4°0.4°
B19B14C7B1210.1°10.1°
B14B19B10B1864.9°64.9°
B14B19B11B1864.7°64.7°
B19B14B15B1363.3°63.3°
B11B19B10B1298.7°98.7°
B19B11B17B18100.9°100.9°
B19B11B17B1064.9°64.9°
B19B11B17B1364.9°64.9°
B19B11B18B1366.0°66.0°
B19B11B18B120.9°0.9°
B11B19C3C763.1°63.1°
B11B19C3B121.4°1.4°
B11B19B10B1836.8°36.8°
B11B19B14B150.7°0.7°
B12B10B11B170.2°0.2°
B10B12B13B170.3°0.3°
B10B12B18B13138.2°138.2°
B10B12B18C797.8°97.8°
B12B10B18B19102.3°102.3°
B12B10B18B11138.5°138.5°
B10B12B18B17100.1°100.1°
B10B12B13B1561.5°61.5°
B11B17B13B1836.6°36.6°
B17B11B18B12103.7°103.7°
B11B17B13B120.2°0.2°
B17B11B10B1836.4°36.4°
B11B17B15B141.8°1.8°
B17B13B18B12138.1°138.1°
B17B13C7C368.1°68.1°
B17B13B12C359.9°59.9°
B17B13B18B10100.5°100.5°
B13B17B18B16102.0°102.0°
B13B17B11B100.0°0.0°
B13B17B16B141.1°1.1°
B13B18B12B11101.0°101.0°
B18B13C7C34.9°4.9°
B18B13B12B15100.0°100.0°
B13B18B12C399.4°99.4°
B13B18B10B1199.1°99.1°
B13B18B10B1962.9°62.9°
B18B13B15B1462.0°62.0°
B18B12C7C3100.9°100.9°
B18B12C3B1466.1°66.1°
B12B18B17B1662.4°62.4°
H1C1C2H950.7°50.8°
H1C1C2H1069.0°68.9°
H1C1C4H11174.0°173.9°
H1C1C4H1257.3°57.3°
H2C1C2H968.2°68.2°
H2C1C2H10172.1°172.1°
H2C1C4H1167.1°67.1°
H2C1C4H12176.2°176.2°
H3C6C2H9131.1°131.1°
H3C6C2H10109.2°109.2°
H4C6C2H9109.7°109.7°
H4C6C2H1010.0°10.0°
H11C4C7C337.3°37.3°
H11C4C7B1232.4°32.4°
H12C4C7C379.4°79.4°
H12C4C7B12149.1°149.1°
C7C3B10B180.7°0.7°
C7C3B10B1161.4°61.4°
B13B12C3B144.9°4.9°
B13B12B10B1961.5°61.5°
B13B12B10B110.3°0.3°
B12B13B17B1661.9°61.9°
B12B13B15B141.5°1.5°
C3B12B18B1761.4°61.4°
C3B12B18B111.6°1.6°
B12C3B14B1665.6°65.6°
C3B12B13B151.9°1.9°
B12C3B14B155.6°5.6°
C7B12B18B172.4°2.4°
C7B12B10B192.8°2.8°
C7B12B18B1160.6°60.6°
C7B12B10B1158.9°58.9°
B12C7B14B1670.8°70.8°
B14C3B10B1864.2°64.2°
B14C3B10B112.1°2.1°
C3B14B16B1762.5°62.5°
C3B14B15B134.2°4.2°
B10B18B17B160.9°0.9°
B10B18B13B1561.3°61.3°
B17B18B10B190.9°0.9°
B18B17B16B1462.5°62.5°
B18B17B15B1464.0°64.0°
B10B19B16B170.0°0.0°
B10B19B14B1564.2°64.2°
B18B11B16B1464.7°64.7°
B11B18B13B152.6°2.6°
B10B11B16B140.7°0.7°

222624

PDB entries from 2024-07-17

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