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2QE

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
OCdoub1.21Å1.25Å
NCAsing1.47Å1.48Å
CCAsing1.51Å1.53Å
COXTsing1.34Å1.25Å
CACBsing1.53Å1.53Å
OAGCD2doub1.21Å1.25Å
OADCD2sing1.34Å1.26Å
CD2CGsing1.51Å1.53Å
CBCGsing1.53Å1.54Å
CGCD1sing1.53Å1.54Å
CAAOAKsing1.45Å1.43Å
OAKCANsing1.34Å1.36Å
OAECANdoub1.21Å1.24Å
CANCAHsing1.51Å1.54Å
CD1CAHsing1.53Å1.54Å
OXTH1sing0.97Å0.95Å
CAH2sing1.09Å1.10Å
NH3sing1.01Å1.00Å
NH4sing1.01Å1.00Å
CBH6sing1.09Å1.10Å
CBH7sing1.09Å1.10Å
CGH8sing1.09Å1.10Å
OADH9sing0.97Å0.95Å
CD1H10sing1.09Å1.10Å
CD1H11sing1.09Å1.10Å
CAHH12sing1.09Å1.10Å
CAHH13sing1.09Å1.10Å
CAAH14sing1.09Å1.10Å
CAAH15sing1.09Å1.10Å
CAAH16sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
OCCA116.7°120.0°
OCOXT126.2°120.0°
NCAC108.8°109.4°
NCACB112.3°109.5°
NCAH2108.3°109.4°
CANH3109.5°111.0°
CANH4109.4°111.0°
CACOXT117.1°120.0°
CCACB111.7°109.5°
CCAH2107.8°109.5°
COXTH1109.5°117.0°
CACBCG113.8°109.5°
CBCAH2107.7°109.5°
CACBH6108.4°109.5°
CACBH7108.4°109.5°
OAGCD2OAD125.0°120.0°
OAGCD2CG118.4°120.0°
OADCD2CG116.6°120.0°
CD2OADH9109.5°117.0°
CD2CGCB109.4°109.5°
CD2CGCD1111.6°109.5°
CD2CGH8108.4°109.5°
CBCGCD1110.8°109.5°
CGCBH6108.4°109.4°
CGCBH7108.4°109.4°
CBCGH8108.2°109.5°
CGCD1CAH114.0°109.4°
CD1CGH8108.3°109.5°
CGCD1H10108.3°109.5°
CGCD1H11108.4°109.5°
CAAOAKCAN115.3°117.0°
OAKCAAH14109.5°109.5°
OAKCAAH15109.5°109.5°
OAKCAAH16109.5°109.4°
OAKCANOAE125.6°120.0°
OAKCANCAH114.6°120.0°
OAECANCAH119.8°120.0°
CANCAHCD1110.6°109.5°
CANCAHH12109.2°109.5°
CANCAHH13109.2°109.5°
CAHCD1H10108.3°109.5°
CAHCD1H11108.3°109.5°
CD1CAHH12109.2°109.5°
CD1CAHH13109.2°109.5°
H3NH4109.5°111.0°
H6CBH7109.5°109.4°
H10CD1H11109.5°109.5°
H12CAHH13109.5°109.4°
H14CAAH15109.4°109.5°
H14CAAH16109.5°109.5°
H15CAAH16109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
OCCAN6.9°20.0°
OCCAOXT178.3°179.8°
OCCACB131.5°100.0°
OCOXTH10.0°0.1°
OCCAH2110.4°140.0°
NCACCB124.6°120.0°
NCACH2117.3°120.0°
NCACOXT174.7°159.7°
NCACBH2119.2°120.0°
NCACBCG73.9°65.0°
CANH3H4120.0°124.0°
NCACBH646.8°55.0°
NCACBH7165.5°175.0°
CCACBH2118.2°120.0°
CCACBCG163.5°175.0°
CACOXTH1178.2°179.7°
CCANH3180.0°60.0°
CCANH460.0°176.0°
CCACBH675.9°65.0°
CCACBH742.9°55.0°
OXTCCACB50.1°80.3°
OXTCCAH268.0°39.8°
CACBCGCD270.9°65.0°
CACBCGH6120.6°120.0°
CACBCGH7120.6°120.1°
CACBCGCD1165.6°175.0°
CBCANH355.7°60.0°
CBCANH4175.7°64.0°
CACBH6H7118.0°120.1°
CACBCGH847.0°55.0°
OAGCD2OADCG179.2°180.0°
OAGCD2CGCB16.2°0.0°
OAGCD2CGCD1106.8°120.0°
OAGCD2CGH8134.1°120.0°
OAGCD2OADH90.0°0.0°
OADCD2CGCB163.1°180.0°
OADCD2CGCD173.9°60.0°
OADCD2CGH845.2°60.0°
CD2CGCBCD1123.5°120.0°
CD2CGCBH8117.9°120.0°
CD2CGCD1H8119.2°120.0°
CD2CGCD1CAH164.8°65.0°
CD2CGCBH6168.4°175.0°
CD2CGCBH749.7°55.1°
CGCD2OADH9179.3°180.0°
CD2CGCD1H1074.6°175.0°
CD2CGCD1H1144.1°55.0°
CBCGCD1H8118.6°120.0°
CBCGCD1CAH73.0°175.0°
CGCBCAH245.3°55.0°
CGCBH6H7118.0°119.9°
CBCGCD1H1047.6°55.0°
CBCGCD1H11166.3°65.0°
CGCD1CAHCAN60.8°180.0°
CGCD1CAHH10120.7°120.0°
CGCD1CAHH11120.7°120.0°
CD1CGCBH645.0°55.0°
CD1CGCBH773.7°64.9°
CGCD1H10H11118.0°120.0°
CGCD1CAHH12179.1°60.0°
CGCD1CAHH1359.4°60.0°
CAAOAKCANOAE13.4°0.0°
CAAOAKCANCAH167.3°180.0°
OAKCAAH14H15120.0°120.0°
OAKCAAH14H16120.0°119.9°
OAKCAAH15H16120.0°120.0°
OAKCANOAECAH179.2°180.0°
OAKCANCAHCD1124.1°180.0°
OAKCANCAHH12115.7°60.0°
OAKCANCAHH133.9°60.0°
CANOAKCAAH14180.0°60.0°
CANOAKCAAH1560.0°60.0°
CANOAKCAAH1660.0°180.0°
OAECANCAHCD156.6°0.0°
OAECANCAHH1263.6°120.0°
OAECANCAHH13176.7°120.0°
CANCAHCD1H12120.2°120.0°
CANCAHCD1H13120.2°120.1°
CANCAHCD1H10178.6°60.0°
CANCAHCD1H1159.9°60.0°
CANCAHH12H13119.5°120.0°
CAHCD1CGH845.6°55.0°
CAHCD1H10H11117.9°120.0°
CD1CAHH12H13119.5°120.0°
H2CANH363.1°180.0°
H2CANH456.9°56.0°
H2CACBH6166.0°175.0°
H2CACBH775.3°65.0°
H6CBCGH873.6°65.1°
H7CBCGH8167.6°175.0°
H8CGCD1H10166.2°65.0°
H8CGCD1H1175.1°175.0°
H10CD1CAHH1258.4°180.0°
H10CD1CAHH1361.3°60.0°
H11CD1CAHH1260.2°60.0°
H11CD1CAHH13179.9°180.0°
H14CAAH15H16120.0°120.0°

223166

PDB entries from 2024-07-31

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