LP8

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C	C2	sing	1.40Å	1.42Å
C	O3	doub	1.22Å	1.33Å
N	C	sing	1.34Å	1.36Å
O	N	sing	1.42Å	1.17Å
O	HO	sing	0.97Å	0.95Å
C1	C2	doub	1.37Å	1.41Å
C2	C11	sing	1.51Å	1.53Å
C4	N	sing	1.38Å	1.35Å
C4	C5	doub	1.41Å	1.39Å	Aromatic
C5	C1	sing	1.47Å	1.40Å
C6	C5	sing	1.40Å	1.39Å	Aromatic
C6	H6	sing	1.08Å	1.08Å
C7	C6	doub	1.38Å	1.39Å	Aromatic
C7	H7	sing	1.08Å	1.08Å
C8	C7	sing	1.39Å	1.39Å	Aromatic
C8	N9	doub	1.32Å	1.36Å	Aromatic
C8	H8	sing	1.08Å	1.08Å
N9	C4	sing	1.33Å	1.35Å	Aromatic
O10	C1	sing	1.35Å	1.33Å
O10	H151	sing	0.97Å	0.95Å
C11	C12	sing	1.54Å	1.54Å
C11	H11	sing	1.09Å	1.10Å
C12	C13	sing	1.54Å	1.52Å
C12	H12	sing	1.09Å	1.10Å
C12	H12A	sing	1.09Å	1.10Å
C13	H13	sing	1.09Å	1.10Å
C13	H13A	sing	1.09Å	1.10Å
C14	C13	sing	1.55Å	1.53Å
C14	H14	sing	1.09Å	1.10Å
C14	H14A	sing	1.09Å	1.10Å
C15	C11	sing	1.54Å	1.55Å
C15	C14	sing	1.55Å	1.54Å
C15	H15	sing	1.09Å	1.10Å
C15	H15A	sing	1.09Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C2	C	O3	123.5°	119.0°
C2	C	N	116.5°	121.9°
C	C2	C1	117.4°	120.0°
C	C2	C11	119.8°	120.0°
O3	C	N	119.9°	119.1°
C	N	O	119.1°	119.4°
C	N	C4	127.9°	121.3°
N	O	HO	109.5°	114.0°
O	N	C4	113.0°	119.3°
C1	C2	C11	122.8°	120.0°
C2	C1	C5	122.7°	118.3°
C2	C1	O10	124.8°	120.8°
C2	C11	C12	111.3°	110.0°
C2	C11	H11	101.7°	110.0°
C2	C11	C15	116.4°	110.1°
N	C4	C5	116.7°	119.3°
N	C4	N9	119.5°	120.8°
C4	C5	C1	118.8°	119.2°
C4	C5	C6	117.1°	119.5°
C5	C4	N9	123.8°	119.9°
C1	C5	C6	124.1°	121.3°
C5	C1	O10	112.5°	120.9°
C5	C6	H6	119.8°	121.0°
C5	C6	C7	120.4°	118.0°
H6	C6	C7	119.8°	121.0°
C6	C7	H7	120.6°	120.3°
C6	C7	C8	118.8°	119.4°
H7	C7	C8	120.6°	120.3°
C7	C8	N9	122.1°	121.6°
C7	C8	H8	118.9°	119.2°
N9	C8	H8	119.0°	119.2°
C8	N9	C4	117.8°	121.6°
C1	O10	H151	109.5°	114.0°
C12	C11	H11	114.5°	110.0°
C11	C12	C13	108.5°	106.6°
C11	C12	H12	109.8°	110.1°
C11	C12	H12A	109.8°	110.0°
C12	C11	C15	104.2°	106.6°
H11	C11	C15	109.1°	110.1°
C13	C12	H12	109.8°	110.0°
C13	C12	H12A	109.8°	110.0°
C12	C13	H13	111.6°	110.5°
C12	C13	H13A	111.6°	110.5°
C12	C13	C14	103.3°	104.2°
H12	C12	H12A	109.2°	110.0°
H13	C13	H13A	107.2°	110.4°
H13	C13	C14	111.6°	110.5°
H13A	C13	C14	111.6°	110.6°
C13	C14	H14	111.7°	110.8°
C13	C14	H14A	111.7°	110.8°
C13	C14	C15	103.0°	102.8°
H14	C14	H14A	107.2°	110.6°
H14	C14	C15	111.7°	110.7°
H14A	C14	C15	111.7°	110.9°
C11	C15	C14	104.6°	104.2°
C11	C15	H15	111.1°	110.5°
C11	C15	H15A	111.1°	110.5°
C14	C15	H15	111.1°	110.5°
C14	C15	H15A	111.1°	110.5°
H15	C15	H15A	107.8°	110.6°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C2	C	O3	N	177.8°	179.7°
C2	C	N	O	178.8°	179.9°
C	C2	C1	C11	178.4°	179.9°
C2	C	N	C4	1.0°	0.0°
C	C2	C1	C5	0.1°	0.6°
C	C2	C1	O10	178.7°	179.9°
C	C2	C11	C12	97.2°	60.1°
C	C2	C11	H11	25.1°	178.6°
C	C2	C11	C15	143.5°	57.1°
O3	C	N	O	3.2°	0.3°
O3	C	C2	C1	178.7°	180.0°
O3	C	C2	C11	2.9°	0.1°
O3	C	N	C4	179.0°	179.6°
C	N	O	C4	178.1°	179.9°
C	N	O	HO	1.5°	0.1°
N	C	C2	C1	0.7°	0.3°
N	C	C2	C11	179.2°	179.7°
C	N	C4	C5	0.4°	0.1°
C	N	C4	N9	179.9°	180.0°
O	N	C4	C5	178.3°	180.0°
O	N	C4	N9	2.0°	0.1°
HO	O	N	C4	179.6°	180.0°
C2	C1	C5	C4	0.7°	0.5°
C2	C1	C5	O10	178.8°	179.5°
C2	C1	C5	C6	179.0°	179.7°
C2	C1	O10	H151	180.0°	179.9°
C1	C2	C11	C12	81.1°	120.0°
C1	C2	C11	H11	156.6°	1.4°
C1	C2	C11	C15	38.1°	122.8°
C11	C2	C1	C5	178.3°	179.5°
C11	C2	C1	O10	0.3°	0.0°
C2	C11	C12	H11	114.6°	121.4°
C2	C11	C12	C15	126.3°	119.3°
C2	C11	H11	C15	123.6°	121.5°
C2	C11	C12	C13	127.1°	119.3°
C2	C11	C12	H12	112.9°	121.4°
C2	C11	C12	H12A	7.1°	0.0°
C2	C11	C15	C14	147.7°	142.9°
C2	C11	C15	H15	27.7°	24.2°
C2	C11	C15	H15A	92.2°	98.4°
N	C4	C5	N9	179.6°	179.9°
N	C4	C5	C1	0.5°	0.2°
N	C4	C5	C6	178.9°	180.0°
N	C4	N9	C8	179.2°	179.9°
C4	C5	C1	C6	178.3°	179.8°
C4	C5	C6	H6	178.6°	180.0°
C4	C5	C6	C7	1.4°	0.1°
C5	C4	N9	C8	0.4°	0.0°
C4	C5	C1	O10	179.5°	180.0°
C1	C5	C6	H6	0.3°	0.2°
C1	C5	C6	C7	179.7°	179.7°
C1	C5	C4	N9	179.2°	179.7°
C5	C1	O10	H151	1.2°	0.5°
C5	C6	H6	C7	180.0°	179.9°
C5	C6	C7	H7	178.3°	180.0°
C5	C6	C7	C8	1.7°	0.0°
C6	C5	C4	N9	0.7°	0.1°
C6	C5	C1	O10	2.2°	0.2°
H6	C6	C7	H7	1.7°	0.0°
H6	C6	C7	C8	178.3°	180.0°
C6	C7	H7	C8	180.0°	180.0°
C6	C7	C8	N9	1.4°	0.0°
C6	C7	C8	H8	178.6°	180.0°
H7	C7	C8	N9	178.6°	180.0°
H7	C7	C8	H8	1.4°	0.0°
C7	C8	N9	H8	180.0°	179.9°
C7	C8	N9	C4	0.7°	0.0°
H8	C8	N9	C4	179.3°	180.0°
C12	C11	H11	C15	116.3°	117.2°
C11	C12	C13	H12	120.0°	119.3°
C11	C12	C13	H12A	120.0°	119.3°
C11	C12	H12	H12A	120.4°	121.4°
C11	C12	C13	H13	143.3°	142.3°
C11	C12	C13	H13A	96.8°	95.2°
C11	C12	C13	C14	23.3°	23.6°
C12	C11	C15	C14	24.7°	23.6°
C12	C11	C15	H15	95.3°	95.1°
C12	C11	C15	H15A	144.8°	142.3°
H11	C11	C12	C13	118.3°	119.3°
H11	C11	C12	H12	1.7°	0.0°
H11	C11	C12	H12A	121.8°	121.4°
H11	C11	C15	C14	97.9°	95.7°
H11	C11	C15	H15	142.1°	145.6°
H11	C11	C15	H15A	22.1°	23.0°
C13	C12	H12	H12A	120.4°	121.4°
C12	C13	H13	H13A	122.5°	122.5°
C12	C13	H13	C14	115.0°	114.8°
C12	C13	H13A	C14	115.0°	114.9°
C12	C13	C14	H14	81.8°	80.4°
C12	C13	C14	H14A	158.2°	156.4°
C13	C12	C11	C15	0.9°	0.0°
C12	C13	C14	C15	38.2°	38.0°
H12	C12	C13	H13	23.3°	23.0°
H12	C12	C13	H13A	143.2°	145.5°
H12	C12	C13	C14	96.7°	95.7°
H12	C12	C11	C15	120.8°	119.3°
H12A	C12	C13	H13	96.7°	98.4°
H12A	C12	C13	H13A	23.3°	24.1°
H12A	C12	C13	C14	143.3°	142.9°
H12A	C12	C11	C15	119.1°	119.3°
H13	C13	H13A	C14	122.5°	122.6°
H13	C13	C14	H14	38.3°	38.3°
H13	C13	C14	H14A	81.8°	84.9°
H13	C13	C14	C15	158.2°	156.6°
H13A	C13	C14	H14	158.2°	160.9°
H13A	C13	C14	H14A	38.2°	37.7°
H13A	C13	C14	C15	81.8°	80.8°
C13	C14	H14	H14A	122.6°	123.3°
C13	C14	H14	C15	114.7°	113.3°
C13	C14	H14A	C15	114.7°	113.4°
C13	C14	C15	C11	39.4°	37.9°
C13	C14	C15	H15	80.6°	80.7°
C13	C14	C15	H15A	159.5°	156.6°
H14	C14	H14A	C15	122.7°	123.3°
H14	C14	C15	C11	80.6°	80.4°
H14	C14	C15	H15	159.4°	160.9°
H14	C14	C15	H15A	39.5°	38.2°
H14A	C14	C15	C11	159.4°	156.3°
H14A	C14	C15	H15	39.4°	37.7°
H14A	C14	C15	H15A	80.6°	85.0°
C11	C15	C14	H15	120.0°	118.7°
C11	C15	C14	H15A	120.0°	118.6°
C11	C15	H15	H15A	122.0°	122.6°
C14	C15	H15	H15A	122.0°	122.7°

Definition date:	2010-02-10
Last modified:	2011-06-04
Release status:	REL
Processing site:	RCSB
Derived from:	3LP1