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0UM

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CAACAJsing1.53Å1.53Å
CAJCAKsing1.53Å1.53Å
OAFCAZsing1.43Å1.40Å
CAKNARsing1.47Å1.48Å
CAZCBBsing1.54Å1.52Å
CAZCBAsing1.55Å1.52Å
NARCAYsing1.47Å1.48Å
CANCBBsing1.53Å1.53Å
CANCAYsing1.53Å1.57Å
CBBOASsing1.44Å1.44Å
CBAOAGsing1.43Å1.42Å
CBACBCsing1.55Å1.55Å
CAYCAMsing1.53Å1.56Å
C8N7doub1.30Å1.33ÅAromatic
C8N9sing1.36Å1.34ÅAromatic
N7C5sing1.35Å1.34ÅAromatic
OASCBCsing1.44Å1.44Å
CBCN9sing1.46Å1.48Å
N9C4sing1.37Å1.33ÅAromatic
CAMCBsing1.53Å1.54Å
C5C4doub1.40Å1.35ÅAromatic
C5C6sing1.41Å1.35ÅAromatic
C4N3sing1.33Å1.36ÅAromatic
N6C6sing1.38Å1.33Å
C6N1doub1.33Å1.34ÅAromatic
N3C2doub1.32Å1.39ÅAromatic
N1C2sing1.32Å1.40ÅAromatic
CBCAsing1.53Å1.52Å
CANsing1.47Å1.48Å
CACsing1.51Å1.56Å
OXTCdoub1.21Å1.25Å
COsing1.34Å1.24Å
C8H1sing1.08Å1.08Å
OH2sing0.97Å0.95Å
CAH3sing1.09Å1.10Å
NH4sing1.01Å1.00Å
NH5sing1.01Å1.00Å
CBH7sing1.09Å1.10Å
CBH8sing1.09Å1.10Å
CAMH9sing1.09Å1.10Å
CAMH10sing1.09Å1.10Å
CAYH11sing1.09Å1.10Å
NARH12sing1.01Å1.00Å
CAKH14sing1.09Å1.10Å
CAKH15sing1.09Å1.10Å
CAJH16sing1.09Å1.10Å
CAJH17sing1.09Å1.10Å
CAAH18sing1.09Å1.10Å
CAAH19sing1.09Å1.10Å
CAAH20sing1.09Å1.10Å
CANH21sing1.09Å1.10Å
CANH22sing1.09Å1.10Å
CBBH23sing1.09Å1.10Å
CAZH24sing1.09Å1.10Å
OAFH25sing0.97Å0.95Å
CBAH26sing1.09Å1.10Å
OAGH27sing0.97Å0.95Å
CBCH28sing1.09Å1.10Å
C2H29sing1.08Å1.08Å
N6H30sing0.97Å1.00Å
N6H31sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CAACAJCAK111.6°109.5°
CAACAJH16108.9°109.5°
CAACAJH17108.9°109.5°
CAJCAAH18109.5°109.5°
CAJCAAH19109.5°109.5°
CAJCAAH20109.5°109.5°
CAJCAKNAR108.3°109.5°
CAJCAKH14109.7°109.5°
CAJCAKH15109.7°109.4°
CAKCAJH16108.9°109.5°
CAKCAJH17108.9°109.4°
OAFCAZCBB107.3°110.5°
OAFCAZCBA110.6°110.5°
OAFCAZH24113.4°110.5°
CAZOAFH25109.5°113.9°
CAKNARCAY118.4°111.0°
CAKNARH12107.2°111.0°
NARCAKH14109.8°109.5°
NARCAKH15109.8°109.5°
CBBCAZCBA101.8°104.2°
CAZCBBCAN109.4°109.9°
CAZCBBOAS106.2°107.3°
CAZCBBH23110.2°110.0°
CBBCAZH24111.6°110.5°
CAZCBAOAG110.3°110.9°
CAZCBACBC102.5°102.1°
CBACAZH24111.5°110.5°
CAZCBAH26111.3°110.9°
NARCAYCAN110.6°109.5°
NARCAYCAM110.6°109.5°
NARCAYH11108.3°109.5°
CAYNARH12107.2°111.0°
CBBCANCAY112.8°109.5°
CANCBBOAS109.9°109.9°
CBBCANH21108.6°109.5°
CBBCANH22108.6°109.5°
CANCBBH23110.0°109.9°
CANCAYCAM112.6°109.5°
CANCAYH11107.2°109.4°
CAYCANH21108.6°109.5°
CAYCANH22108.6°109.4°
CBBOASCBC109.3°107.0°
OASCBBH23111.2°109.9°
OAGCBACBC108.5°111.0°
OAGCBAH26112.9°110.8°
CBAOAGH27109.5°114.1°
CBACBCOAS105.9°103.5°
CBACBCN9111.3°110.6°
CBCCBAH26110.8°110.9°
CBACBCH28109.9°110.6°
CAYCAMCB113.3°109.4°
CAYCAMH9108.5°109.4°
CAYCAMH10108.5°109.5°
CAMCAYH11107.3°109.5°
N7C8N9107.4°109.9°
C8N7C5108.6°109.4°
N7C8H1126.3°125.0°
C8N9CBC128.0°126.2°
C8N9C4108.9°107.5°
N9C8H1126.3°125.0°
N7C5C4107.5°107.2°
N7C5C6133.1°134.6°
OASCBCN9107.2°110.6°
OASCBCH28111.5°110.7°
CBCN9C4122.4°126.3°
N9CBCH28110.9°110.6°
N9C4C5107.4°106.0°
N9C4N3130.5°134.9°
CAMCBCA114.3°109.5°
CAMCBH7108.3°109.4°
CAMCBH8108.3°109.5°
CBCAMH9108.5°109.5°
CBCAMH10108.5°109.5°
C4C5C6119.4°118.2°
C5C4N3122.1°119.1°
C5C6N6118.6°120.8°
C5C6N1121.3°118.4°
C4N3C2118.6°120.7°
N6C6N1120.0°120.7°
C6N6H30109.5°120.0°
C6N6H31109.5°120.0°
C6N1C2120.0°121.2°
N3C2N1118.5°122.5°
N3C2H29120.8°118.8°
N1C2H29120.7°118.8°
CBCAN109.9°109.5°
CBCAC110.0°109.5°
CBCAH3107.8°109.4°
CACBH7108.2°109.5°
CACBH8108.3°109.5°
NCAC113.0°109.4°
NCAH3108.4°109.5°
CANH4109.5°111.0°
CANH5109.5°111.0°
CACOXT119.0°120.0°
CACO117.7°120.0°
CCAH3107.5°109.5°
OXTCO123.2°120.0°
COH2109.5°117.0°
H4NH5109.4°111.0°
H7CBH8109.4°109.5°
H9CAMH10109.5°109.5°
H14CAKH15109.5°109.5°
H16CAJH17109.5°109.4°
H18CAAH19109.5°109.4°
H18CAAH20109.4°109.4°
H19CAAH20109.5°109.5°
H21CANH22109.5°109.4°
H30N6H31109.5°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CAACAJCAKH16120.3°120.1°
CAACAJCAKH17120.3°120.0°
CAACAJCAKNAR177.3°180.0°
CAACAJCAKH1462.9°59.9°
CAACAJCAKH1557.5°60.0°
CAACAJH16H17119.0°120.0°
CAJCAAH18H19120.0°120.0°
CAJCAAH18H20120.0°120.0°
CAJCAAH19H20120.0°120.0°
CAJCAKNARH14119.8°120.0°
CAJCAKNARH15119.8°119.9°
CAJCAKNARCAY180.0°179.9°
CAJCAKNARH1258.7°56.1°
CAJCAKH14H15120.5°119.9°
CAKCAJH16H17119.0°119.9°
CAKCAJCAAH18180.0°59.9°
CAKCAJCAAH1960.0°60.0°
CAKCAJCAAH2060.0°179.9°
OAFCAZCBBCBA116.2°118.7°
OAFCAZCBBH24124.8°122.6°
OAFCAZCBAH24127.1°122.7°
OAFCAZCBBCAN90.1°119.9°
OAFCAZCBBOAS151.4°120.7°
OAFCAZCBAOAG34.6°20.5°
OAFCAZCBACBC150.1°97.8°
OAFCAZCBBH2330.9°1.2°
OAFCAZCBAH2691.5°144.0°
CAKNARCAYH12121.3°124.0°
CAKNARCAYCAN49.0°60.0°
CAKNARCAYCAM76.5°60.0°
CAKNARCAYH11166.1°180.0°
NARCAKH14H15120.6°120.1°
NARCAKCAJH1657.0°59.9°
NARCAKCAJH1762.4°60.0°
CBBCAZCBAH24119.1°118.7°
CAZCBBCANOAS116.2°117.8°
CAZCBBCANH23121.1°121.1°
CAZCBBCANCAY171.3°175.7°
CAZCBBOASH23119.8°119.5°
CBBCAZCBAOAG79.1°139.1°
CBBCAZCBACBC36.3°20.9°
CAZCBBOASCBC19.6°26.5°
CAZCBBCANH2150.8°64.3°
CAZCBBCANH2268.2°55.7°
CBBCAZOAFH25180.0°180.0°
CBBCAZCBAH26154.7°97.4°
CBACAZCBBCAN153.7°121.5°
CBACAZCBBOAS35.2°2.0°
CAZCBAOAGCBC111.6°112.8°
CAZCBAOAGH26125.2°123.6°
CAZCBACBCH26118.8°118.2°
CAZCBACBCOAS25.7°37.0°
CAZCBACBCN990.4°155.6°
CBACAZCBBH2385.3°117.4°
CBACAZOAFH2569.8°65.2°
CAZCBAOAGH27180.0°61.4°
CAZCBACBCH28146.3°81.5°
NARCAYCANCBB155.6°65.0°
NARCAYCANCAM124.4°120.0°
NARCAYCANH11117.8°120.0°
NARCAYCAMH11117.9°120.0°
NARCAYCAMCB100.7°65.0°
NARCAYCAMH919.9°175.0°
NARCAYCAMH10138.7°54.9°
CAYNARCAKH1460.2°60.0°
CAYNARCAKH1560.2°60.0°
NARCAYCANH2135.1°175.0°
NARCAYCANH2283.9°55.0°
CBBCANCAYH21120.5°120.0°
CBBCANCAYH22120.5°120.0°
CANCBBOASH23122.0°121.1°
CBBCANCAYCAM80.0°175.0°
CANCBBOASCBC137.8°145.9°
CBBCANCAYH1137.8°55.0°
CBBCANH21H22118.5°120.0°
CANCBBCAZH2434.7°2.8°
CAYCANCBBOAS72.5°66.5°
CANCAYCAMH11117.7°119.9°
CANCAYCAMCB134.9°174.9°
CANCAYCAMH9104.5°55.0°
CANCAYCAMH1014.4°65.1°
CANCAYNARH1272.3°63.9°
CAYCANH21H22118.4°120.0°
CAYCANCBBH2350.2°54.5°
CBBOASCBCCBA4.0°40.1°
CBBOASCBCN9114.9°158.6°
OASCBBCANH21167.0°53.5°
OASCBBCANH2248.0°173.5°
OASCBBCAZH2483.8°116.7°
CBBOASCBCH28123.5°78.4°
OAGCBACBCH26124.5°123.6°
OAGCBACBCOAS90.9°155.3°
OAGCBACBCN9152.9°86.2°
OAGCBACAZH24161.8°102.2°
OAGCBACBCH2829.6°36.7°
CBACBCN9C898.8°90.5°
CBACBCOASN9118.9°118.5°
CBACBCOASH28119.5°118.5°
CBACBCN9H28122.7°122.9°
CBACBCN9C470.7°89.7°
CBCCBACAZH2482.8°139.5°
CBCCBAOAGH2768.4°174.1°
CAYCAMCBH9120.6°119.9°
CAYCAMCBH10120.6°120.0°
CAYCAMCBCA81.3°180.0°
CAYCAMCBH739.4°60.0°
CAYCAMCBH8158.0°60.0°
CAYCAMH9H10118.2°120.0°
CAMCAYNARH12162.2°176.1°
CAMCAYCANH21159.5°55.0°
CAMCAYCANH2240.5°65.0°
N7C8N9H1180.0°179.9°
N7C8N9CBC174.8°180.0°
N7C8N9C44.2°0.2°
C8N7C5C40.7°0.1°
C8N7C5C6179.2°179.9°
N9C8N7C52.1°0.1°
C8N9CBCOAS16.6°23.6°
C8N9CBCC4169.5°179.7°
C8N9C4C54.6°0.3°
C8N9C4N3178.4°179.9°
C8N9CBCH28138.5°146.6°
N7C5C4N93.2°0.2°
N7C5C4C6178.8°180.0°
N7C5C4N3179.4°180.0°
N7C5C6N60.2°0.1°
N7C5C6N1176.3°180.0°
C5N7C8H1177.9°180.0°
OASCBCN9H28121.9°123.0°
OASCBCN9C4173.9°156.2°
CBCOASCBBH23100.2°93.0°
OASCBCCBAH26144.6°81.2°
CBCN9C4C5175.8°179.9°
CBCN9C4N37.1°0.3°
CBCN9C8H15.2°0.1°
N9CBCCBAH2628.4°37.4°
N9C4C5N3177.4°179.7°
N9C4C5C6178.0°179.7°
N9C4N3C2177.9°179.7°
C4N9C8H1175.8°179.9°
C4N9CBCH2852.0°33.2°
CAMCBCAH7120.7°120.0°
CAMCBCAH8120.7°120.1°
CAMCBCAN71.9°65.0°
CAMCBCAC163.0°175.0°
CAMCBCAH346.1°55.0°
CAMCBH7H8117.8°120.0°
CBCAMH9H10118.3°120.0°
CBCAMCAYH1117.2°55.0°
C4C5C6N6178.2°179.9°
C4C5C6N12.1°0.0°
C5C4N3C21.2°0.0°
C6C5C4N30.6°0.0°
C5C6N6N1176.1°179.9°
C5C6N1C24.2°0.1°
C5C6N6H30176.2°0.1°
C5C6N6H3163.8°180.0°
C4N3C2N10.9°0.0°
C4N3C2H29179.1°179.9°
N6C6N1C2179.8°180.0°
C6N6H30H31120.0°179.8°
C6N1C2N33.5°0.1°
C6N1C2H29176.5°180.0°
N1C6N6H300.0°180.0°
N1C6N6H31120.0°0.2°
N3C2N1H29180.0°179.9°
CBCANC123.3°120.0°
CBCANH3117.7°120.0°
CBCACH3117.1°120.0°
CBCACOXT47.6°100.0°
CBCACO137.4°80.0°
CBCANH4180.0°176.0°
CBCANH560.0°60.0°
CACBH7H8117.8°120.0°
CACBCAMH9158.1°60.1°
CACBCAMH1039.3°60.0°
NCACH3119.6°120.0°
NCACOXT170.9°20.0°
NCACO14.2°160.0°
CANH4H5120.0°124.0°
NCACBH7167.3°55.0°
NCACBH848.8°175.0°
CACOXTO174.6°179.9°
CACOH2174.7°180.0°
CCANH456.7°64.0°
CCANH563.3°60.0°
CCACBH742.3°65.0°
CCACBH876.2°55.0°
OXTCOH20.0°0.1°
OXTCCAH369.5°140.1°
OCCAH3105.4°40.0°
H3CANH462.3°56.0°
H3CANH5177.7°180.0°
H3CACBH774.6°175.0°
H3CACBH8166.9°65.0°
H7CBCAMH981.2°180.0°
H7CBCAMH10160.0°60.0°
H8CBCAMH937.4°60.0°
H8CBCAMH1081.5°180.0°
H9CAMCAYH11137.8°65.0°
H10CAMCAYH11103.4°175.0°
H11CAYNARH1244.9°56.0°
H11CAYCANH2182.7°65.0°
H11CAYCANH22158.3°175.0°
H12NARCAKH14178.5°64.0°
H12NARCAKH1561.1°176.0°
H14CAKCAJH16176.8°180.0°
H14CAKCAJH1757.5°60.0°
H15CAKCAJH1662.8°60.1°
H15CAKCAJH17177.8°180.0°
H16CAJCAAH1859.7°180.0°
H16CAJCAAH1960.3°60.0°
H16CAJCAAH20179.7°60.0°
H17CAJCAAH1859.7°60.0°
H17CAJCAAH19179.7°180.0°
H17CAJCAAH2060.3°60.0°
H18CAAH19H20120.0°120.0°
H21CANCBBH2370.3°174.6°
H22CANCBBH23170.6°65.4°
H23CBBCAZH24155.7°123.9°
H24CAZOAFH2556.3°57.4°
H24CAZCBAH2635.7°21.3°
H26CBAOAGH2754.8°62.2°
H26CBACBCH2894.9°160.3°

222415

PDB entries from 2024-07-10

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