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LJB

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O11MO1sing1.70Å1.90Å
O12MO1sing1.70Å1.83Å
O13MO1sing1.71Å2.00Å
O13MO2sing1.71Å2.23Å
O13MO4sing1.78Å2.08Å
O14MO1sing1.71Å2.21Å
O14MO7sing1.71Å2.20Å
O14MO8sing1.77Å2.20Å
O21MO2sing1.70Å1.84Å
O22MO2sing1.70Å1.80Å
O23MO2sing1.70Å2.10Å
O24MO2sing1.71Å2.01Å
O24MO3sing1.71Å2.19Å
O24MO8sing1.77Å2.18Å
O25MO1sing1.70Å2.02Å
O25MO2sing1.70Å2.00Å
O31MO3sing1.70Å1.80Å
O32MO3sing1.70Å1.80Å
O33MO3sing1.70Å2.02Å
O33MO5sing1.70Å2.25Å
O34MO3sing1.71Å1.99Å
O34MO4sing1.77Å2.09Å
O34MO5sing1.70Å2.21Å
O41MO4sing1.75Å1.80Å
O51MO5sing1.70Å1.80Å
O52MO5sing1.70Å1.80Å
O53MO4sing2.06Å2.38Å
O53MO5sing1.71Å2.02Å
O53MO6sing1.71Å2.04Å
O53MO8sing1.77Å2.22Å
O61MO6sing1.70Å1.80Å
O62MO6sing1.70Å1.80Å
O63MO5sing1.70Å2.02Å
O63MO6sing1.70Å2.01Å
O64MO6sing1.70Å1.95Å
O64MO7sing1.70Å2.09Å
O71MO7sing1.70Å1.80Å
O72MO7sing1.70Å1.80Å
O73MO1sing1.70Å2.12Å
O73MO7sing1.70Å2.06Å
O74MO4sing1.77Å2.11Å
O74MO6sing1.70Å2.11Å
O74MO7sing1.71Å2.11Å
O81MO8sing1.75Å1.82Å
O23MO3sing1.70Å2.68Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O11MO1O1285.6°93.0°
O11MO1O1394.0°94.1°
O11MO1O14166.7°164.2°
O11MO1O25118.6°100.8°
O11MO1O73101.2°90.1°
O12MO1O13155.1°163.7°
O12MO1O1490.3°92.9°
O12MO1O2575.6°90.0°
O12MO1O73106.8°98.3°
MO1O13MO293.1°104.9°
MO1O13MO4123.3°122.8°
O13MO1O1495.1°84.1°
O13MO1O2582.9°74.3°
O13MO1O7397.7°96.3°
MO2O13MO4119.6°123.2°
O13MO2O21148.6°163.8°
O13MO2O2278.1°94.7°
O13MO2O2378.3°95.4°
O13MO2O2487.6°84.1°
O13MO2O2577.8°74.3°
O13MO4O34116.3°108.3°
O13MO4O41105.8°108.7°
O13MO4O53121.2°112.1°
O13MO4O74106.9°108.2°
MO1O14MO7106.5°104.9°
MO1O14MO8115.8°122.1°
O14MO1O2572.3°93.8°
O14MO1O7367.9°74.6°
MO7O14MO8105.4°116.9°
O14MO7O64129.0°96.6°
O14MO7O71148.3°163.6°
O14MO7O7277.4°91.1°
O14MO7O7369.2°74.5°
O14MO7O7490.3°87.1°
O14MO8O24108.3°109.8°
O14MO8O53110.3°103.6°
O14MO8O81107.3°113.1°
O21MO2O2292.5°93.0°
O21MO2O23130.7°98.8°
O21MO2O24102.5°92.3°
O21MO2O2573.3°90.4°
O22MO2O2382.8°89.8°
O22MO2O24164.8°164.1°
O22MO2O2595.5°100.5°
O23MO2O2489.3°74.6°
O23MO2O25155.9°165.9°
MO2O23MO389.7°105.8°
MO2O24MO3107.8°104.8°
MO2O24MO8119.9°121.7°
O24MO2O2586.4°94.4°
MO3O24MO8117.3°117.3°
O24MO3O31121.9°92.1°
O24MO3O32165.3°163.7°
O24MO3O3383.7°95.8°
O24MO3O3486.8°87.3°
O24MO3O2371.9°74.5°
O24MO8O5396.3°103.6°
O24MO8O81123.2°113.1°
MO1O25MO299.7°105.7°
O25MO1O73140.1°165.9°
O31MO3O3269.4°91.6°
O31MO3O3391.0°92.1°
O31MO3O34150.7°164.2°
O31MO3O2398.7°101.3°
O32MO3O3386.9°99.9°
O32MO3O3481.3°93.4°
O32MO3O23117.7°89.2°
MO3O33MO597.3°107.3°
O33MO3O3485.9°72.3°
O33MO3O23155.3°163.7°
O33MO5O3475.6°72.5°
O33MO5O51104.1°97.6°
O33MO5O52132.7°86.3°
O33MO5O53101.1°95.0°
O33MO5O63159.6°164.5°
MO3O34MO4118.3°122.8°
MO3O34MO599.2°106.8°
O34MO3O2396.0°93.7°
MO4O34MO5127.2°118.6°
O34MO4O41107.3°108.7°
O34MO4O5352.8°58.0°
O34MO4O74115.8°114.1°
O34MO5O51109.1°99.1°
O34MO5O52148.8°157.5°
O34MO5O5356.3°66.5°
O34MO5O6391.1°101.8°
O41MO4O53133.0°139.2°
O41MO4O74103.5°108.7°
O51MO5O5279.5°90.8°
O51MO5O53146.1°157.0°
O51MO5O6394.7°97.6°
O52MO5O5399.6°109.3°
O52MO5O6358.0°96.8°
MO4O53MO5122.0°104.3°
MO4O53MO6105.4°103.9°
MO4O53MO889.6°87.5°
O53MO4O7464.8°58.1°
MO5O53MO6115.8°106.4°
MO5O53MO8111.6°123.6°
O53MO5O6358.5°69.6°
MO6O53MO8109.1°124.2°
O53MO6O61143.9°156.9°
O53MO6O62101.8°109.8°
O53MO6O6358.3°69.7°
O53MO6O64134.3°94.6°
O53MO6O7471.2°66.6°
O53MO8O81110.7°112.8°
O61MO6O6282.2°90.6°
O61MO6O6386.9°98.1°
O61MO6O6481.5°97.7°
O61MO6O74118.5°98.7°
O62MO6O6384.1°96.2°
O62MO6O6485.7°86.1°
O62MO6O74154.2°157.6°
MO5O63MO6117.4°107.1°
O63MO6O64165.6°164.0°
O63MO6O74110.6°102.6°
MO6O64MO795.8°107.3°
O64MO6O7482.7°72.5°
O64MO7O7182.4°99.4°
O64MO7O72116.1°92.0°
O64MO7O73152.6°163.6°
O64MO7O7479.2°72.3°
O71MO7O7293.2°91.9°
O71MO7O7380.1°89.1°
O71MO7O7492.4°94.4°
O72MO7O7385.9°101.7°
O72MO7O74164.3°163.9°
MO1O73MO7115.8°105.8°
O73MO7O7480.7°93.2°
MO4O74MO6113.0°118.1°
MO4O74MO7131.5°123.3°
MO6O74MO790.5°106.8°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O11MO1O12O1389.9°115.8°
O11MO1O12O14167.3°165.3°
O11MO1O12O25121.1°100.9°
O11MO1O12O73100.4°90.5°
O11MO1O13O14170.2°164.2°
O11MO1O13O25118.4°100.1°
O11MO1O13O73101.9°90.5°
O11MO1O13MO2100.0°93.1°
O11MO1O13MO4131.1°119.2°
O11MO1O14O25146.5°157.8°
O11MO1O14O7336.4°14.1°
O11MO1O14MO742.3°17.9°
O11MO1O14MO8159.1°118.1°
O11MO1O25O73175.8°140.3°
O11MO1O25MO269.9°84.2°
O11MO1O73MO7178.7°180.0°
O12MO1O13O14101.7°80.1°
O12MO1O13O2530.3°15.6°
O12MO1O13O73170.1°153.8°
O12MO1O13MO212.0°22.6°
O12MO1O13MO4140.8°125.1°
O12MO1O14O2574.8°90.2°
O12MO1O14O73108.1°97.9°
O12MO1O14MO7114.0°94.1°
O12MO1O14MO8129.2°129.9°
O12MO1O25O7399.2°126.6°
O12MO1O25MO2146.5°177.2°
O12MO1O73MO790.0°86.9°
MO1O13MO2MO4131.5°147.5°
O13MO1O14O2580.9°73.7°
O13MO1O14O7396.2°98.2°
O13MO1O14MO790.4°102.0°
O13MO1O14MO826.4°34.0°
MO1O13MO2O214.6°25.6°
MO1O13MO2O2279.5°92.6°
MO1O13MO2O23164.5°177.2°
MO1O13MO2O24105.7°103.3°
O13MO1O25O7393.5°49.0°
MO1O13MO2O2518.8°7.0°
MO1O13MO4O34124.2°133.3°
MO1O13MO4O41116.8°108.8°
MO1O13MO4O5363.4°71.2°
O13MO1O73MO785.7°85.9°
MO1O13MO4O746.9°9.1°
MO2O13MO1O1489.7°102.7°
O13MO2O21O2271.0°118.4°
O13MO2O21O23153.7°151.4°
O13MO2O21O24106.3°76.6°
O13MO2O21O2523.9°17.8°
O13MO2O22O2379.5°95.4°
O13MO2O22O2420.1°84.9°
O13MO2O22O2576.3°74.8°
O13MO2O23O2487.7°82.4°
O13MO2O23O258.0°42.2°
O13MO2O24O2578.0°73.6°
O13MO2O24MO388.4°101.3°
O13MO2O24MO849.4°34.8°
MO2O13MO4O347.6°8.6°
MO2O13MO4O41126.6°109.3°
MO2O13MO4O5353.1°70.7°
MO2O13MO1O73158.1°176.4°
MO2O13MO4O74123.5°132.8°
O13MO2O23MO395.5°86.4°
MO4O13MO1O1439.1°45.0°
MO4O13MO2O21136.1°122.0°
MO4O13MO2O22149.0°119.9°
MO4O13MO2O2363.9°29.7°
MO4O13MO2O2425.9°44.2°
MO4O13MO1O25110.5°140.7°
MO4O13MO2O25112.7°140.5°
O13MO4O34MO38.3°4.1°
O13MO4O34O41118.2°118.0°
O13MO4O34O53110.5°105.1°
O13MO4O34O74126.8°120.5°
O13MO4O34MO5121.2°133.9°
O13MO4O41O53179.7°180.0°
O13MO4O41O74112.3°117.5°
O13MO4O53O7495.2°98.3°
O13MO4O53MO5112.0°124.1°
O13MO4O53MO6113.2°124.6°
O13MO4O53MO83.4°0.0°
MO4O13MO1O7329.2°28.7°
O13MO4O74MO6135.2°134.5°
O13MO4O74MO722.4°3.4°
MO1O14MO7MO8123.5°138.7°
MO1O14MO8O2417.7°3.9°
O14MO1O25O734.2°33.7°
O14MO1O25MO2118.5°89.8°
MO1O14MO8O5386.6°106.2°
MO1O14MO7O64150.1°169.8°
MO1O14MO7O7121.1°2.2°
MO1O14MO7O7296.4°98.1°
MO1O14MO7O736.0°3.8°
MO1O14MO7O7473.9°97.9°
MO1O14MO8O81152.8°131.4°
MO7O14MO8O24135.1°135.1°
MO7O14MO1O25171.2°175.8°
MO7O14MO8O5330.8°25.0°
O14MO7O64MO654.9°92.8°
O14MO7O64O71175.4°176.5°
O14MO7O64O7294.8°91.3°
O14MO7O64O73124.8°56.0°
O14MO7O64O7481.5°84.8°
O14MO7O71O7271.0°100.1°
O14MO7O71O7314.3°1.6°
O14MO7O71O7494.3°94.7°
O14MO7O72O7369.6°74.4°
O14MO7O72O7438.9°83.3°
O14MO7O73O7493.9°86.1°
O14MO7O74MO416.4°36.1°
O14MO7O74MO6105.6°105.8°
MO7O14MO8O8189.9°97.5°
O14MO8O24MO21.1°3.4°
O14MO8O24MO3135.0°134.4°
O14MO8O24O53113.9°110.1°
O14MO8O24O81126.3°127.5°
MO8O14MO1O2554.4°39.7°
O14MO8O53MO454.7°57.3°
O14MO8O53MO5179.3°162.9°
O14MO8O53MO651.5°47.8°
O14MO8O53O81118.6°122.7°
MO8O14MO7O6426.6°31.1°
MO8O14MO7O71144.6°136.5°
MO8O14MO7O72140.1°123.2°
MO8O14MO1O73122.7°132.2°
MO8O14MO7O73129.6°134.9°
MO8O14MO7O7449.7°40.8°
O21MO2O22O23130.7°98.8°
O21MO2O22O24169.9°109.4°
O21MO2O22O2573.5°90.9°
O21MO2O23O24105.9°89.9°
O21MO2O23O25174.4°130.1°
O21MO2O24O2572.0°90.6°
O21MO2O24MO3121.6°94.5°
O21MO2O24MO8100.6°129.4°
O21MO2O25MO1148.6°178.0°
O21MO2O23MO398.1°85.9°
O22MO2O23O24167.0°177.0°
O22MO2O23O2587.3°136.9°
O22MO2O24O2597.6°160.0°
O22MO2O24MO368.7°14.9°
O22MO2O24MO869.1°121.1°
O22MO2O25MO157.7°84.8°
O22MO2O23MO3174.8°178.9°
O23MO2O24O25156.3°170.9°
MO2O23MO3O247.5°4.1°
O23MO2O24MO8127.7°132.1°
O23MO2O25MO126.9°51.1°
MO2O23MO3O31113.3°85.0°
MO2O23MO3O32175.5°176.5°
MO2O23MO3O331.1°59.4°
MO2O23MO3O3492.1°90.2°
MO2O24MO3MO8139.0°138.4°
O24MO2O25MO1107.2°89.7°
MO2O24MO3O3180.9°97.2°
MO2O24MO3O32141.5°5.8°
MO2O24MO3O33168.1°170.6°
MO2O24MO3O34105.6°98.7°
MO2O24MO8O53112.8°106.8°
MO2O24MO8O81127.4°130.8°
MO3O24MO2O25166.3°174.9°
O24MO3O31O32169.5°164.2°
O24MO3O31O3383.2°95.9°
O24MO3O31O34166.6°87.3°
O24MO3O31O2374.1°74.7°
O24MO3O32O3350.0°164.6°
O24MO3O32O3436.3°91.9°
O24MO3O32O23128.6°1.8°
O24MO3O33O3487.2°85.2°
O24MO3O33O238.3°52.8°
O24MO3O33MO598.1°93.2°
O24MO3O34O2371.5°74.3°
O24MO3O34MO446.5°37.2°
O24MO3O34MO595.0°104.9°
MO3O24MO8O5321.2°24.2°
MO3O24MO8O8198.7°98.2°
MO8O24MO2O2528.6°38.9°
MO8O24MO3O31140.1°124.5°
MO8O24MO3O322.5°132.5°
MO8O24MO3O3352.9°32.2°
MO8O24MO3O3433.4°39.7°
O24MO8O53MO457.6°57.4°
O24MO8O53MO567.0°48.2°
O24MO8O53MO6163.8°162.5°
O24MO8O53O81129.1°122.6°
MO8O24MO3O23130.8°134.4°
O25MO1O73MO72.4°38.9°
MO2O25MO1O73114.3°56.1°
O25MO2O23MO387.5°44.2°
O31MO3O32O3392.3°92.4°
O31MO3O32O34178.6°165.0°
O31MO3O32O2389.2°101.3°
O31MO3O33O34150.8°177.6°
O31MO3O33O23113.7°145.1°
O31MO3O33MO5139.9°174.5°
O31MO3O34O23119.9°162.3°
O31MO3O34MO4144.9°125.2°
O31MO3O34MO573.7°16.9°
O32MO3O33O3481.5°90.5°
O32MO3O33O23177.0°122.9°
O32MO3O33MO570.6°82.5°
O32MO3O34O23117.2°89.4°
O32MO3O34MO4142.2°126.6°
O32MO3O34MO576.4°91.3°
O33MO3O34O23155.3°171.3°
O33MO3O34MO4130.3°134.2°
MO3O33MO5O3410.1°8.0°
MO3O33MO5O5196.4°89.3°
MO3O33MO5O52175.0°179.5°
MO3O33MO5O5360.7°71.4°
MO3O33MO5O6360.6°78.5°
O33MO5O34MO4126.2°136.0°
O33MO5O34O51100.2°95.1°
O33MO5O34O52158.3°19.9°
O33MO5O34O53114.2°103.7°
O33MO5O34O63164.4°165.1°
O33MO5O51O52131.7°86.3°
O33MO5O51O53136.8°122.3°
O33MO5O51O63172.1°176.7°
O33MO5O52O53114.9°93.9°
O33MO5O52O63158.0°164.7°
O33MO5O53MO474.1°93.0°
O33MO5O53O63179.9°178.0°
O33MO5O53MO6155.3°157.5°
O33MO5O53MO829.7°3.6°
O33MO5O63MO625.7°13.2°
MO5O33MO3O23106.4°40.4°
MO3O34MO4MO5129.5°137.9°
MO3O34MO4O41109.9°113.9°
MO3O34MO5O5190.0°87.2°
MO3O34MO5O52168.6°27.9°
MO3O34MO4O53118.8°109.2°
MO3O34MO5O53124.4°111.6°
MO3O34MO5O63174.7°173.0°
MO3O34MO4O74135.1°124.6°
O34MO4O41O5354.9°62.3°
O34MO4O41O74122.9°124.8°
MO4O34MO5O51133.6°128.9°
MO4O34MO5O5232.1°116.1°
O34MO4O53O74163.7°163.4°
MO4O34MO5O5312.0°32.4°
O34MO4O53MO6145.8°137.0°
O34MO4O53MO8104.4°98.4°
MO4O34MO5O6338.2°29.0°
O34MO4O74MO63.8°14.0°
O34MO4O74MO7109.0°124.0°
MO4O34MO3O2325.0°37.2°
MO5O34MO4O41120.7°108.2°
O34MO5O51O52149.0°159.7°
O34MO5O51O5357.4°49.0°
O34MO5O51O6392.8°103.4°
O34MO5O52O5336.0°74.9°
O34MO5O52O637.2°145.7°
O34MO5O53O63115.7°113.6°
O34MO5O53MO6140.5°134.1°
O34MO5O53MO893.9°72.0°
O34MO5O63MO674.0°79.8°
MO5O34MO4O745.7°13.3°
MO5O34MO3O23166.4°179.2°
O41MO4O53O7485.1°81.7°
O41MO4O53MO567.6°55.9°
O41MO4O53MO667.2°55.4°
O41MO4O53MO8176.9°180.0°
O41MO4O74MO6113.3°107.5°
O41MO4O74MO7133.9°114.5°
O51MO5O52O53145.6°168.5°
O51MO5O52O63102.4°97.8°
O51MO5O53MO463.3°29.8°
O51MO5O53O6342.6°59.2°
O51MO5O53MO667.3°79.7°
O51MO5O53MO8167.1°126.4°
O51MO5O63MO6176.7°179.1°
O52MO5O53MO4148.7°179.2°
O52MO5O53O6342.8°90.2°
O52MO5O53MO618.1°69.7°
O52MO5O53MO8107.5°84.2°
O52MO5O63MO6102.2°87.4°
MO4O53MO5MO6130.6°109.5°
MO4O53MO5MO8103.8°96.6°
MO4O53MO6MO895.1°96.5°
MO4O53MO6O6195.8°28.4°
MO4O53MO6O62171.3°178.6°
MO4O53MO5O63105.8°89.0°
MO4O53MO6O63113.2°89.2°
MO4O53MO6O6475.7°93.9°
MO4O53MO6O7417.1°25.2°
O53MO4O74MO794.7°108.5°
MO4O53MO8O81173.3°180.0°
MO5O53MO6MO8126.8°153.7°
MO5O53MO6O6142.3°81.4°
MO5O53MO6O6250.6°68.9°
MO5O53MO6O6324.9°20.5°
MO5O53MO6O64146.2°156.3°
MO5O53MO4O74152.8°137.6°
MO5O53MO6O74155.2°135.0°
MO5O53MO8O8162.1°74.5°
O53MO6O61O6299.3°152.2°
O53MO6O61O6314.8°55.8°
O53MO6O61O64173.9°121.7°
O53MO6O61O7497.0°48.3°
O53MO6O62O6355.9°70.6°
O53MO6O62O64134.4°93.5°
O53MO6O62O7471.0°76.4°
O53MO6O63O64153.4°11.5°
O53MO6O63O7450.4°58.9°
O53MO6O64O7454.6°63.7°
O53MO6O64MO728.3°71.6°
O53MO6O74MO7116.0°111.1°
MO6O53MO8O8167.1°74.8°
MO8O53MO6O61169.1°124.9°
MO8O53MO6O6276.3°84.8°
MO8O53MO5O63150.4°174.4°
MO8O53MO6O63151.7°174.2°
MO8O53MO6O6419.3°2.6°
MO8O53MO4O7491.8°98.3°
MO8O53MO6O7478.0°71.3°
O61MO6O62O6387.7°98.2°
O61MO6O62O6482.0°97.7°
O61MO6O62O74145.4°114.9°
O61MO6O63MO5164.8°179.6°
O61MO6O63O6436.8°171.2°
O61MO6O63O74119.4°100.9°
O61MO6O64O74120.4°96.7°
O61MO6O64MO7146.7°88.8°
O61MO6O74MO4121.6°128.3°
O61MO6O74MO7102.1°87.5°
O62MO6O63MO582.4°88.1°
O62MO6O63O6445.7°97.3°
O62MO6O63O74158.2°167.7°
O62MO6O64O74156.9°173.2°
O62MO6O64MO7130.6°178.8°
O62MO6O74MO498.2°118.3°
O62MO6O74MO738.1°25.8°
MO5O63MO6O64128.0°9.2°
MO5O63MO6O7475.8°79.6°
O63MO6O64O74157.6°74.5°
O63MO6O64MO7176.1°82.4°
O63MO6O74MO423.6°27.9°
O63MO6O74MO7159.9°172.1°
MO6O64MO7O71120.4°83.7°
MO6O64MO7O72149.7°175.9°
MO6O64MO7O7369.9°36.8°
O64MO6O74MO4162.3°136.3°
MO6O64MO7O7426.5°7.9°
O64MO7O71O72115.9°92.3°
O64MO7O71O73158.9°165.9°
O64MO7O71O7478.8°72.8°
O64MO7O72O73162.9°171.0°
O64MO7O72O74166.4°13.4°
O64MO7O73MO1130.3°62.6°
O64MO7O73O7443.1°27.4°
O64MO7O74MO4146.2°134.0°
O71MO7O72O7379.8°89.5°
O71MO7O72O74110.5°112.8°
O71MO7O73MO1178.7°175.7°
O71MO7O73O7494.1°94.3°
O71MO7O74MO4132.0°127.6°
O71MO7O74MO6106.0°90.6°
O72MO7O73MO184.8°84.0°
O72MO7O73O74172.0°173.9°
O72MO7O74MO421.4°119.9°
O72MO7O74MO6143.3°22.0°
MO1O73MO7O7487.2°90.0°
O73MO7O74MO452.4°38.2°
O73MO7O74MO6174.4°179.9°
MO4O74MO6MO7136.4°144.2°

259987

PDB entries from 2026-09-23

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