FLU

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C1	O1	sing	1.36Å	1.23Å
C1	C2	doub	1.38Å	1.42Å	Aromatic
C1	C13	sing	1.40Å	1.33Å	Aromatic
O1	HO1	sing	0.97Å	0.95Å
C2	C3	sing	1.39Å	1.40Å	Aromatic
C2	H2	sing	1.08Å	1.10Å
C3	O2	sing	1.35Å	1.49Å	Aromatic
C3	C11	doub	1.41Å	1.33Å	Aromatic
O2	C4	sing	1.35Å	1.22Å	Aromatic
C4	C5	doub	1.38Å	1.41Å	Aromatic
C4	C9	sing	1.41Å	1.33Å	Aromatic
C5	C6	sing	1.40Å	1.39Å	Aromatic
C5	H5	sing	1.08Å	1.10Å
C6	O3	doub	1.23Å	1.23Å
C6	C7	sing	1.41Å	1.37Å	Aromatic
C7	C8	doub	1.36Å	1.42Å	Aromatic
C7	H7	sing	1.08Å	1.10Å
C8	C9	sing	1.41Å	1.39Å	Aromatic
C8	H8	sing	1.08Å	1.10Å
C9	C10	doub	1.41Å	1.46Å	Aromatic
C10	C11	sing	1.46Å	1.33Å	Aromatic
C10	C14	sing	1.47Å	1.32Å	Aromatic
C11	C12	sing	1.40Å	1.43Å	Aromatic
C12	C13	doub	1.36Å	1.41Å	Aromatic
C12	H12	sing	1.08Å	1.10Å
C13	H13	sing	1.08Å	1.10Å
C14	C15	doub	1.40Å	1.39Å	Aromatic
C14	C19	sing	1.41Å	1.42Å	Aromatic
C15	C16	sing	1.38Å	1.38Å	Aromatic
C15	H15	sing	1.08Å	1.10Å
C16	C17	doub	1.38Å	1.44Å	Aromatic
C16	H16	sing	1.08Å	1.10Å
C17	C18	sing	1.38Å	1.40Å	Aromatic
C17	H17	sing	1.08Å	1.10Å
C18	C19	doub	1.39Å	1.37Å	Aromatic
C18	H18	sing	1.08Å	1.10Å
C19	C20	sing	1.48Å	1.41Å
C20	O4	doub	1.21Å	1.38Å
C20	O5	sing	1.35Å	1.34Å
O5	HO5	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O1	C1	C2	115.0°	119.7°
O1	C1	C13	122.0°	119.7°
C1	O1	HO1	115.0°	106.8°
C2	C1	C13	122.9°	120.6°
C1	C2	C3	112.6°	119.9°
C1	C2	H2	124.3°	120.0°
C1	C13	C12	124.0°	120.4°
C1	C13	H13	115.1°	119.8°
C3	C2	H2	123.1°	120.0°
C2	C3	O2	111.7°	120.3°
C2	C3	C11	125.8°	119.2°
O2	C3	C11	122.4°	120.4°
C3	O2	C4	108.1°	122.4°
C3	C11	C10	129.2°	119.1°
C3	C11	C12	121.1°	120.1°
O2	C4	C5	105.4°	119.6°
O2	C4	C9	129.6°	121.1°
C5	C4	C9	125.0°	119.3°
C4	C5	C6	113.0°	119.8°
C4	C5	H5	124.0°	120.1°
C4	C9	C8	121.7°	120.2°
C4	C9	C10	126.4°	119.5°
C6	C5	H5	122.9°	120.0°
C5	C6	O3	117.3°	119.8°
C5	C6	C7	123.6°	120.4°
O3	C6	C7	119.1°	119.8°
C6	C7	C8	121.1°	120.2°
C6	C7	H7	117.6°	119.9°
C8	C7	H7	121.3°	119.9°
C7	C8	C9	115.4°	120.0°
C7	C8	H8	123.0°	120.0°
C9	C8	H8	121.6°	120.0°
C8	C9	C10	111.9°	120.3°
C9	C10	C11	104.2°	117.6°
C9	C10	C14	124.1°	121.2°
C11	C10	C14	131.7°	121.2°
C10	C11	C12	109.7°	120.9°
C10	C14	C15	124.6°	120.2°
C10	C14	C19	118.2°	120.2°
C11	C12	C13	113.5°	119.8°
C11	C12	H12	123.8°	120.1°
C13	C12	H12	122.7°	120.1°
C12	C13	H13	121.0°	119.8°
C15	C14	C19	117.1°	119.5°
C14	C15	C16	126.5°	120.0°
C14	C15	H15	116.9°	120.0°
C14	C19	C18	114.8°	119.6°
C14	C19	C20	130.8°	120.2°
C16	C15	H15	116.6°	120.1°
C15	C16	C17	118.3°	120.5°
C15	C16	H16	119.0°	119.7°
C17	C16	H16	122.7°	119.8°
C16	C17	C18	112.6°	120.5°
C16	C17	H17	124.8°	119.8°
C18	C17	H17	122.7°	119.8°
C17	C18	C19	130.8°	120.0°
C17	C18	H18	115.9°	120.0°
C19	C18	H18	113.3°	120.0°
C18	C19	C20	114.4°	120.2°
C19	C20	O4	108.7°	120.0°
C19	C20	O5	131.9°	120.0°
O4	C20	O5	119.3°	120.0°
C20	O5	HO5	131.9°	120.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O1	C1	C2	C13	176.7°	180.0°
O1	C1	C2	C3	179.5°	180.0°
O1	C1	C2	H2	0.5°	0.0°
O1	C1	C13	C12	177.6°	179.9°
O1	C1	C13	H13	2.4°	0.1°
C2	C1	O1	HO1	180.0°	90.0°
C1	C2	C3	H2	180.0°	180.0°
C1	C2	C3	O2	177.9°	180.0°
C1	C2	C3	C11	3.4°	0.2°
C2	C1	C13	C12	1.2°	0.0°
C2	C1	C13	H13	178.8°	180.0°
C13	C1	O1	HO1	3.3°	90.0°
C13	C1	C2	C3	3.8°	0.0°
C13	C1	C2	H2	176.1°	180.0°
C1	C13	C12	C11	2.1°	0.3°
C1	C13	C12	H13	180.0°	180.0°
C1	C13	C12	H12	177.9°	180.0°
C2	C3	O2	C11	178.8°	179.9°
C2	C3	O2	C4	180.0°	180.0°
C2	C3	C11	C10	179.7°	179.7°
C2	C3	C11	C12	0.2°	0.4°
H2	C2	C3	O2	2.2°	0.0°
H2	C2	C3	C11	176.6°	179.8°
C3	O2	C4	C5	178.7°	180.0°
C3	O2	C4	C9	0.5°	0.1°
O2	C3	C11	C10	1.7°	0.4°
O2	C3	C11	C12	178.8°	179.7°
C11	C3	O2	C4	1.2°	0.1°
C3	C11	C10	C9	0.4°	0.4°
C3	C11	C10	C12	179.5°	179.3°
C3	C11	C10	C14	178.3°	179.8°
C3	C11	C12	C13	2.6°	0.5°
C3	C11	C12	H12	177.4°	179.8°
O2	C4	C5	C9	179.3°	179.9°
O2	C4	C5	C6	178.2°	180.0°
O2	C4	C5	H5	1.8°	0.1°
O2	C4	C9	C8	178.7°	180.0°
O2	C4	C9	C10	1.9°	0.0°
C4	C5	C6	H5	180.0°	179.9°
C4	C5	C6	O3	180.0°	179.9°
C4	C5	C6	C7	2.2°	0.1°
C5	C4	C9	C8	2.2°	0.1°
C5	C4	C9	C10	177.1°	179.9°
C9	C4	C5	C6	2.6°	0.1°
C9	C4	C5	H5	177.5°	180.0°
C4	C9	C8	C7	1.2°	0.1°
C4	C9	C8	C10	179.4°	180.0°
C4	C9	C8	H8	178.8°	180.0°
C4	C9	C10	C11	1.4°	0.2°
C4	C9	C10	C14	179.8°	180.0°
C5	C6	O3	C7	177.9°	179.8°
C5	C6	C7	C8	1.5°	0.1°
C5	C6	C7	H7	178.5°	180.0°
H5	C5	C6	O3	0.0°	0.2°
H5	C5	C6	C7	177.8°	180.0°
O3	C6	C7	C8	179.3°	179.9°
O3	C6	C7	H7	0.7°	0.2°
C6	C7	C8	H7	180.0°	180.0°
C6	C7	C8	C9	0.8°	0.0°
C6	C7	C8	H8	179.2°	180.0°
C7	C8	C9	H8	180.0°	179.9°
C7	C8	C9	C10	178.3°	180.0°
H7	C7	C8	C9	179.2°	180.0°
H7	C7	C8	H8	0.8°	0.1°
C8	C9	C10	C11	179.3°	179.8°
C8	C9	C10	C14	0.4°	0.0°
H8	C8	C9	C10	1.7°	0.0°
C9	C10	C11	C14	178.7°	179.7°
C9	C10	C11	C12	179.9°	179.7°
C9	C10	C14	C15	65.5°	90.0°
C9	C10	C14	C19	110.1°	90.6°
C10	C11	C12	C13	177.0°	179.8°
C10	C11	C12	H12	3.0°	0.5°
C11	C10	C14	C15	113.0°	90.3°
C11	C10	C14	C19	71.4°	89.2°
C14	C10	C11	C12	1.2°	0.5°
C10	C14	C15	C19	175.7°	179.5°
C10	C14	C15	C16	174.8°	180.0°
C10	C14	C15	H15	5.1°	0.2°
C10	C14	C19	C18	177.3°	180.0°
C10	C14	C19	C20	4.9°	0.2°
C11	C12	C13	H12	180.0°	179.7°
C11	C12	C13	H13	177.9°	179.7°
H12	C12	C13	H13	2.1°	0.1°
C14	C15	C16	H15	180.0°	179.7°
C14	C15	C16	C17	1.7°	0.3°
C14	C15	C16	H16	178.2°	179.8°
C15	C14	C19	C18	1.3°	0.5°
C15	C14	C19	C20	179.2°	179.7°
C19	C14	C15	C16	0.8°	0.5°
C19	C14	C15	H15	179.2°	179.7°
C14	C19	C18	C17	2.9°	0.3°
C14	C19	C18	C20	178.2°	179.8°
C14	C19	C18	H18	177.1°	179.8°
C14	C19	C20	O4	54.3°	0.2°
C14	C19	C20	O5	122.0°	179.7°
C15	C16	C17	H16	180.0°	179.9°
C15	C16	C17	C18	0.4°	0.1°
C15	C16	C17	H17	179.6°	180.0°
H15	C15	C16	C17	178.3°	179.9°
H15	C15	C16	H16	1.7°	0.0°
C16	C17	C18	H17	180.0°	179.9°
C16	C17	C18	C19	2.0°	0.0°
C16	C17	C18	H18	178.0°	180.0°
H16	C16	C17	C18	179.6°	180.0°
H16	C16	C17	H17	0.4°	0.1°
C17	C18	C19	H18	180.0°	179.9°
C17	C18	C19	C20	178.9°	180.0°
H17	C17	C18	C19	178.0°	180.0°
H17	C17	C18	H18	2.0°	0.1°
C18	C19	C20	O4	127.9°	180.0°
C18	C19	C20	O5	55.9°	0.1°
H18	C18	C19	C20	1.1°	0.0°
C19	C20	O4	O5	176.8°	179.9°
C19	C20	O5	HO5	180.0°	180.0°
O4	C20	O5	HO5	4.1°	0.1°

Definition date:	1999-07-08
Last modified:	2020-06-17
Release status:	REL
Processing site:	RCSB