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LTU

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C5O6sing1.43Å1.46Å
C5C4sing1.53Å1.54Å
O6C4sing1.43Å1.46Å
C2C1sing1.53Å1.56Å
C4C1sing1.53Å1.53Å
C3C1sing1.53Å1.54Å
C1NE1sing1.46Å1.48Å
CZ2CE2doub1.39Å1.42ÅAromatic
CZ2CH2sing1.38Å1.39ÅAromatic
NE1CE2sing1.38Å1.43ÅAromatic
NE1CD1sing1.37Å1.40ÅAromatic
CE2CD2sing1.41Å1.42ÅAromatic
CH2CZ3doub1.39Å1.41ÅAromatic
CD1CGdoub1.34Å1.39ÅAromatic
CD2CGsing1.47Å1.45ÅAromatic
CD2CE3doub1.40Å1.41ÅAromatic
CZ3CE3sing1.37Å1.39ÅAromatic
CGCBsing1.51Å1.49Å
COdoub1.21Å1.24Å
CCAsing1.51Å1.53Å
CBCAsing1.53Å1.60Å
CBOBsing1.43Å1.40Å
CANsing1.47Å1.41Å
CAHAsing1.09Å1.10Å
CBHB2sing1.09Å1.10Å
NHsing1.01Å1.00Å
NH2sing1.01Å1.00Å
CD1HD1sing1.08Å1.08Å
C2H8sing1.09Å1.10Å
C2H9sing1.09Å1.10Å
C2H10sing1.09Å1.10Å
C3H11sing1.09Å1.10Å
C3H12sing1.09Å1.10Å
C3H13sing1.09Å1.10Å
CE3HE3sing1.08Å1.08Å
CZ3HZ3sing1.08Å1.08Å
CH2HH2sing1.08Å1.08Å
CZ2HZ2sing1.08Å1.08Å
OBH18sing0.97Å0.95Å
C4H19sing1.09Å1.10Å
C5H20sing1.09Å1.10Å
C5H21sing1.09Å1.10Å
COXTsing1.34Å34.84Å
OXTHXTsing0.97Å0.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O6C5C458.2°57.6°
C5O6C463.7°64.7°
O6C5H20120.3°117.8°
O6C5H21120.3°117.8°
C5C4O658.1°57.7°
C5C4C1118.3°117.8°
C5C4H19116.4°117.8°
C4C5H20120.3°117.7°
C4C5H21120.3°117.8°
O6C4C1116.9°117.8°
O6C4H19118.0°117.8°
C2C1C4108.6°109.5°
C2C1C3109.7°109.5°
C2C1NE1110.4°109.5°
C1C2H8109.5°109.5°
C1C2H9109.5°109.5°
C1C2H10109.4°109.5°
C4C1C3110.3°109.5°
C4C1NE1108.8°109.5°
C1C4H19116.5°115.7°
C3C1NE1109.1°109.5°
C1C3H11109.5°109.5°
C1C3H12109.5°109.4°
C1C3H13109.5°109.5°
C1NE1CE2128.1°125.1°
C1NE1CD1124.3°125.1°
CE2CZ2CH2120.7°119.8°
CZ2CE2NE1132.2°133.5°
CZ2CE2CD2120.4°119.3°
CE2CZ2HZ2119.6°120.1°
CZ2CH2CZ3119.1°120.6°
CZ2CH2HH2120.5°119.7°
CH2CZ2HZ2119.7°120.1°
CE2NE1CD1107.6°109.8°
NE1CE2CD2107.4°107.1°
NE1CD1CG110.6°110.0°
NE1CD1HD1124.7°125.0°
CE2CD2CG108.0°106.0°
CE2CD2CE3117.9°119.9°
CH2CZ3CE3120.7°120.6°
CH2CZ3HZ3119.7°119.7°
CZ3CH2HH2120.4°119.7°
CD1CGCD2106.4°107.0°
CD1CGCB124.2°126.5°
CGCD1HD1124.7°125.1°
CGCD2CE3134.0°134.0°
CD2CGCB129.4°126.5°
CD2CE3CZ3121.2°119.7°
CD2CE3HE3119.4°120.1°
CZ3CE3HE3119.4°120.1°
CE3CZ3HZ3119.7°119.7°
CGCBCA110.5°109.5°
CGCBOB112.3°109.5°
CGCBHB2109.2°109.5°
OCCA115.9°119.9°
OCOXT157.5°120.0°
CCACB109.1°109.5°
CCAN110.9°109.5°
CCAHA108.0°109.5°
CACOXT86.4°120.0°
CACBOB106.4°109.4°
CBCAN111.9°109.5°
CBCAHA107.2°109.4°
CACBHB2107.9°109.4°
OBCBHB2110.5°109.5°
CBOBH18109.5°114.0°
NCAHA109.6°109.5°
CANH109.5°111.0°
CANH2109.4°111.0°
HNH2109.5°111.0°
H8C2H9109.5°109.5°
H8C2H10109.5°109.4°
H9C2H10109.5°109.5°
H11C3H12109.4°109.5°
H11C3H13109.5°109.5°
H12C3H13109.5°109.5°
H20C5H21109.5°115.7°
COXTHXT90.0°117.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O6C5C4H20109.0°106.8°
O6C5C4H21109.0°106.9°
O6C5C4C1105.6°106.9°
O6C5C4H19108.0°106.9°
O6C5H20H21145.7°147.1°
C5C4C1C236.0°61.4°
C5C4C1H19146.4°146.9°
C5C4C1C384.2°58.7°
C5C4C1NE1156.2°178.6°
C4C5H20H21145.7°147.0°
O6C4C1C230.4°127.5°
O6C4C1H19147.2°146.9°
O6C4C1C3150.6°7.5°
O6C4C1NE189.7°112.5°
C2C1C4C3120.2°120.0°
C2C1C4NE1120.1°120.0°
C2C1C3NE1121.0°120.0°
C2C1NE1CE258.2°60.0°
C2C1NE1CD1123.6°120.3°
C1C2H8H9120.0°120.0°
C1C2H8H10120.0°120.0°
C1C2H9H10120.0°120.1°
C2C1C3H11180.0°180.0°
C2C1C3H1260.0°60.0°
C2C1C3H1360.0°60.0°
C2C1C4H19177.6°85.6°
C4C1C3NE1119.5°120.0°
C4C1NE1CE260.8°180.0°
C4C1NE1CD1117.4°0.3°
C4C1C2H8180.0°180.0°
C4C1C2H960.0°60.0°
C4C1C2H1060.0°60.0°
C4C1C3H1160.5°60.0°
C4C1C3H12179.5°60.0°
C4C1C3H1359.5°180.0°
C1C4C5H203.3°146.3°
C1C4C5H21145.4°0.0°
C3C1NE1CE2178.9°60.0°
C3C1NE1CD13.0°119.7°
C3C1C2H859.5°60.0°
C3C1C2H9179.5°60.0°
C3C1C2H1060.5°180.0°
C1C3H11H12120.0°120.0°
C1C3H11H13120.0°120.0°
C1C3H12H13120.0°120.0°
C3C1C4H1962.2°154.4°
C1NE1CE2CZ20.9°0.3°
C1NE1CE2CD1178.4°179.7°
C1NE1CE2CD2179.5°180.0°
C1NE1CD1CG178.5°179.8°
C1NE1CD1HD11.5°0.3°
NE1C1C2H860.8°60.0°
NE1C1C2H959.2°180.0°
NE1C1C2H10179.2°60.0°
NE1C1C3H1159.0°60.0°
NE1C1C3H1261.0°180.0°
NE1C1C3H13179.0°60.0°
NE1C1C4H1957.5°34.4°
CE2CZ2CH2HZ2180.0°179.8°
CZ2CE2NE1CD2179.7°179.7°
CZ2CE2NE1CD1179.3°180.0°
CE2CZ2CH2CZ30.7°0.5°
CZ2CE2CD2CG178.6°179.8°
CZ2CE2CD2CE30.4°0.2°
CE2CZ2CH2HH2179.3°179.8°
CH2CZ2CE2NE1178.8°179.9°
CH2CZ2CE2CD20.8°0.4°
CZ2CH2CZ3HH2180.0°179.7°
CZ2CH2CZ3CE30.1°0.3°
CZ2CH2CZ3HZ3179.9°179.7°
CE2NE1CD1CG0.0°0.0°
NE1CE2CD2CG1.7°0.4°
NE1CE2CD2CE3179.3°180.0°
CE2NE1CD1HD1180.0°180.0°
NE1CE2CZ2HZ21.2°0.0°
CD1NE1CE2CD21.0°0.3°
NE1CD1CGHD1180.0°180.0°
NE1CD1CGCD21.0°0.2°
NE1CD1CGCB177.9°179.9°
CE2CD2CGCD11.7°0.4°
CE2CD2CGCE3178.8°179.5°
CE2CD2CE3CZ30.1°0.0°
CE2CD2CGCB178.4°179.9°
CE2CD2CE3HE3179.9°180.0°
CD2CE2CZ2HZ2179.1°179.7°
CH2CZ3CE3CD20.3°0.0°
CH2CZ3CE3HZ3180.0°180.0°
CH2CZ3CE3HE3179.7°180.0°
CZ3CH2CZ2HZ2179.3°179.7°
CD1CGCD2CB176.7°179.7°
CD1CGCD2CE3179.5°179.9°
CD1CGCBCA98.4°95.0°
CD1CGCBOB143.1°24.9°
CD1CGCBHB220.1°145.0°
CGCD2CE3CZ3178.9°179.5°
CD2CGCBCA77.8°85.3°
CD2CGCBOB40.8°154.7°
CD2CGCBHB2163.7°34.6°
CD2CGCD1HD1179.0°179.8°
CGCD2CE3HE31.1°0.5°
CD2CE3CZ3HE3180.0°180.0°
CE3CD2CGCB2.8°0.4°
CD2CE3CZ3HZ3179.7°180.0°
CE3CZ3CH2HH2179.9°180.0°
CGCBCAC71.8°175.0°
CGCBCAOB122.1°120.0°
CGCBCAHB2119.3°120.0°
CGCBOBHB2122.2°120.1°
CGCBCAN165.1°55.0°
CGCBCAHA44.8°65.0°
CBCGCD1HD12.1°0.1°
CGCBOBH18180.0°60.0°
OCCAOXT177.3°180.0°
OCCACB63.6°100.0°
OCCAN60.1°20.0°
OCCAHA179.8°140.0°
OCOXTHXT90.0°0.0°
CCACBN123.1°120.1°
CCACBHA116.7°120.0°
CCACBOB166.0°55.0°
CCANHA119.1°120.1°
CCACBHB247.5°65.0°
CCANH180.0°60.0°
CCANH260.0°176.1°
CACOXTHXT90.0°180.0°
CACBOBHB2116.8°119.9°
CBCANHA118.8°119.9°
CBCANH57.9°60.0°
CBCANH2177.9°63.9°
CACBOBH1859.0°60.0°
CBCACOXT119.1°80.0°
OBCBCAN43.0°65.0°
OBCBCAHA77.3°175.0°
NCACBHB275.6°175.0°
CANHH2120.0°123.9°
NCACOXT117.2°160.0°
HACACBHB2164.2°55.0°
HACANH60.9°180.0°
HACANH259.1°56.0°
HACACOXT2.9°40.0°
HB2CBOBH1857.8°179.9°
H8C2H9H10120.0°119.9°
H11C3H12H13120.0°120.0°
HE3CE3CZ3HZ30.3°0.0°
HZ3CZ3CH2HH20.1°0.0°
HH2CH2CZ2HZ20.7°0.0°
H19C4C5H20143.1°0.1°
H19C4C5H211.0°146.2°

223532

PDB entries from 2024-08-07

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