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142

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
NNNsing1.45Å1.43Å
NNCAsing1.47Å1.29Å
NNHNNsing1.01Å1.02Å
NHN1sing1.01Å1.02Å
NHN2sing1.01Å1.02Å
CACBsing1.53Å1.56Å
CACB1sing1.53Å1.54Å
CACsing1.51Å1.52Å
CBCGsing1.51Å1.53Å
CBHB1sing1.09Å1.11Å
CBHB2sing1.09Å1.11Å
CB1HB11sing1.09Å1.12Å
CB1HB12sing1.09Å1.11Å
CB1HB13sing1.09Å1.12Å
CGCD1doub1.38Å1.40ÅAromatic
CGCD2sing1.38Å1.41ÅAromatic
CD1CE1sing1.39Å1.39ÅAromatic
CD1HD1sing1.08Å1.10Å
CE1CZdoub1.39Å1.39ÅAromatic
CE1OE1sing1.36Å1.38Å
CD2CE2doub1.38Å1.43ÅAromatic
CD2HD2sing1.08Å1.10Å
CE2CZsing1.39Å1.41ÅAromatic
CE2HE2sing1.08Å1.10Å
CZOHsing1.36Å1.39Å
OHHHsing0.97Å0.95Å
OE1HE1sing0.97Å0.95Å
COdoub1.21Å1.26Å
COXTsing1.34Å1.25Å
OXTHOXsing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
NNNCA114.6°106.8°
NNNHNN110.4°106.7°
NNNHN1114.6°106.7°
NNNHN2110.4°106.7°
CANNHNN110.3°106.7°
NNCACB113.7°109.5°
NNCACB1108.6°109.5°
NNCAC107.8°109.5°
HN1NHN2110.4°106.7°
CBCACB1109.1°109.4°
CBCAC107.2°109.4°
CACBCG118.1°109.5°
CACBHB1109.1°109.5°
CACBHB2109.1°109.5°
CB1CAC110.3°109.5°
CACB1HB11108.6°109.5°
CACB1HB12112.5°109.4°
CACB1HB13112.6°109.5°
CACO120.2°120.0°
CACOXT114.2°120.0°
CGCBHB1109.1°109.5°
CGCBHB2109.1°109.5°
CBCGCD1120.2°120.0°
CBCGCD2122.0°119.9°
HB1CBHB2101.0°109.4°
HB11CB1HB12112.5°109.5°
HB11CB1HB13112.5°109.5°
HB12CB1HB1397.9°109.5°
CD1CGCD2117.8°120.1°
CGCD1CE1122.0°120.0°
CGCD1HD1119.2°120.0°
CGCD2CE2121.1°120.1°
CGCD2HD2118.8°119.9°
CE1CD1HD1118.8°120.0°
CD1CE1CZ120.2°119.9°
CD1CE1OE1121.0°120.1°
CZCE1OE1118.8°120.0°
CE1CZCE2119.9°119.8°
CE1CZOH117.4°120.1°
CE1OE1HE1121.0°106.8°
CE2CD2HD2120.1°119.9°
CD2CE2CZ119.0°120.0°
CD2CE2HE2121.0°120.0°
CZCE2HE2120.1°120.0°
CE2CZOH122.6°120.0°
CZOHHH117.4°106.9°
OCOXT124.4°120.0°
COXTHOX114.2°120.1°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
NNNCAHNN125.3°113.9°
NNNHN1HN2125.3°113.8°
NNNCACB49.5°180.0°
NNNCACB172.2°60.0°
NNNCAC168.3°60.0°
CANNNHN1180.0°180.0°
CANNNHN254.7°66.2°
NNCACBCB1121.4°120.0°
NNCACBC119.1°120.0°
NNCACB1C118.0°120.0°
NNCACBCG76.8°180.0°
NNCACBHB148.5°60.0°
NNCACBHB2157.9°60.0°
NNCACB1HB11180.0°60.0°
NNCACB1HB1254.7°180.0°
NNCACB1HB1354.8°60.0°
NNCACO144.6°150.0°
NNCACOXT23.7°30.0°
HNNNNNHN154.8°66.1°
HNNNNNHN270.6°179.9°
HNNNNCACB174.8°66.1°
HNNNNCACB153.1°173.9°
HNNNNCAC66.4°53.8°
CBCACB1C117.6°119.9°
CACBCGHB1125.3°120.0°
CACBCGHB2125.3°120.0°
CACBHB1HB2114.8°120.0°
CBCACB1HB1155.5°60.0°
CBCACB1HB12179.2°60.0°
CBCACB1HB1369.7°180.0°
CACBCGCD1104.5°90.3°
CACBCGCD274.1°90.0°
CBCACO92.6°90.0°
CBCACOXT99.1°90.1°
CB1CACBCG44.6°60.0°
CB1CACBHB1169.9°60.0°
CB1CACBHB280.6°180.0°
CACB1HB11HB12125.3°120.0°
CACB1HB11HB13125.3°120.0°
CACB1HB12HB13118.5°120.0°
CB1CACO26.1°30.0°
CB1CACOXT142.1°150.0°
CCACBCG164.1°60.0°
CCACBHB170.6°180.0°
CCACBHB238.8°60.1°
CCACB1HB1162.0°180.0°
CCACB1HB1263.2°60.0°
CCACB1HB13172.8°60.0°
CACOOXT167.0°180.0°
CACOXTHOX180.0°180.0°
CGCBHB1HB2114.8°120.0°
CBCGCD1CD2178.6°179.7°
CBCGCD1CE1178.5°179.8°
CBCGCD1HD11.6°0.3°
CBCGCD2CE2178.4°180.0°
CBCGCD2HD21.7°0.0°
HB1CBCGCD120.8°149.7°
HB1CBCGCD2160.6°30.0°
HB2CBCGCD1130.3°29.7°
HB2CBCGCD251.2°150.0°
HB11CB1HB12HB13118.4°120.0°
CGCD1CE1HD1179.9°179.4°
CGCD1CE1CZ0.0°0.5°
CGCD1CE1OE1179.9°179.7°
CD1CGCD2CE20.2°0.2°
CD1CGCD2HD2179.7°179.7°
CD2CGCD1CE10.1°0.5°
CD2CGCD1HD1179.8°180.0°
CGCD2CE2HD2179.9°180.0°
CGCD2CE2CZ0.2°0.0°
CGCD2CE2HE2179.8°180.0°
CD1CE1CZOE1179.8°179.8°
CD1CE1CZCE20.0°0.2°
CD1CE1CZOH180.0°179.7°
CD1CE1OE1HE1179.9°89.7°
HD1CD1CE1CZ180.0°180.0°
HD1CD1CE1OE10.2°0.3°
CE1CZCE2CD20.1°0.0°
CE1CZCE2OH180.0°179.9°
CE1CZCE2HE2180.0°180.0°
CE1CZOHHH180.0°89.9°
CZCE1OE1HE10.2°90.0°
OE1CE1CZCE2179.9°180.0°
OE1CE1CZOH0.1°0.0°
CD2CE2CZHE2179.9°180.0°
CD2CE2CZOH179.9°180.0°
HD2CD2CE2CZ179.7°180.0°
HD2CD2CE2HE20.2°0.1°
CE2CZOHHH0.0°90.0°
HE2CE2CZOH0.0°0.1°
OCOXTHOX12.3°0.0°

223532

PDB entries from 2024-08-07

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