SKY

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C9	C10	doub	1.38Å	1.40Å	Aromatic
C10	C11	sing	1.40Å	1.40Å	Aromatic
C10	H10	sing	1.08Å	1.08Å
C16	C11	doub	1.42Å	1.40Å	Aromatic
C11	C12	sing	1.41Å	1.40Å	Aromatic
C12	C13	doub	1.36Å	1.40Å	Aromatic
C12	H12	sing	1.08Å	1.08Å
C14	C13	sing	1.39Å	1.40Å	Aromatic
C13	H13	sing	1.08Å	1.08Å
C15	C14	doub	1.36Å	1.40Å	Aromatic
C14	H14	sing	1.08Å	1.08Å
C16	C15	sing	1.41Å	1.40Å	Aromatic
C15	H15	sing	1.08Å	1.08Å
C17	C16	sing	1.41Å	1.40Å	Aromatic
C18	C17	doub	1.36Å	1.40Å	Aromatic
C17	H17	sing	1.08Å	1.08Å
C18	C9	sing	1.40Å	1.40Å	Aromatic
C18	H18	sing	1.08Å	1.08Å
C8	C9	sing	1.48Å	1.40Å	Aromatic
C7	C8	doub	1.37Å	1.34Å	Aromatic
C8	N3	sing	1.35Å	1.34Å	Aromatic
N1	C7	sing	1.35Å	1.34Å	Aromatic
C7	H7	sing	1.08Å	1.08Å
N2	N3	doub	1.29Å	1.23Å	Aromatic
N1	N2	sing	1.29Å	1.24Å	Aromatic
C1	N1	sing	1.47Å	1.48Å
C2	C1	sing	1.53Å	1.54Å
C1	O5	sing	1.43Å	1.46Å
C1	H1	sing	1.09Å	1.10Å
C5	O5	sing	1.43Å	1.45Å
C4	C5	sing	1.53Å	1.56Å
C5	C6	sing	1.53Å	1.53Å
C5	H5	sing	1.09Å	1.10Å
O6	C6	sing	1.43Å	1.43Å
C6	H6	sing	1.09Å	1.10Å
C6	H6A	sing	1.09Å	1.10Å
O6	HO6	sing	0.97Å	0.95Å
O4	C4	sing	1.43Å	1.43Å
C3	C4	sing	1.53Å	1.55Å
C4	H4	sing	1.09Å	1.10Å
O4	HO4	sing	0.97Å	0.95Å
O3	C3	sing	1.43Å	1.44Å
C3	C2	sing	1.53Å	1.55Å
C3	H3	sing	1.09Å	1.10Å
O3	HO3	sing	0.97Å	0.95Å
O2	C2	sing	1.43Å	1.43Å
C2	H2	sing	1.09Å	1.10Å
O2	HO2	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C9	C10	C11	120.8°	119.5°
C9	C10	H10	119.6°	120.2°
C10	C9	C18	119.0°	120.6°
C10	C9	C8	119.8°	119.7°
C11	C10	H10	119.6°	120.3°
C10	C11	C16	119.8°	119.5°
C10	C11	C12	120.4°	121.2°
C16	C11	C12	119.8°	119.4°
C11	C16	C15	120.1°	119.3°
C11	C16	C17	119.7°	119.7°
C11	C12	C13	119.9°	119.7°
C11	C12	H12	120.0°	120.2°
C13	C12	H12	120.0°	120.2°
C12	C13	C14	120.3°	121.0°
C12	C13	H13	119.9°	119.5°
C14	C13	H13	119.9°	119.5°
C13	C14	C15	119.7°	121.0°
C13	C14	H14	120.1°	119.5°
C15	C14	H14	120.1°	119.5°
C14	C15	C16	120.2°	119.7°
C14	C15	H15	119.9°	120.1°
C16	C15	H15	119.9°	120.2°
C15	C16	C17	120.3°	121.0°
C16	C17	C18	120.4°	119.9°
C16	C17	H17	119.8°	120.1°
C18	C17	H17	119.8°	120.0°
C17	C18	C9	120.3°	120.9°
C17	C18	H18	119.8°	119.5°
C9	C18	H18	119.8°	119.6°
C18	C9	C8	121.2°	119.7°
C9	C8	C7	129.2°	126.9°
C9	C8	N3	125.5°	126.9°
C7	C8	N3	105.2°	106.2°
C8	C7	N1	104.7°	106.0°
C8	C7	H7	127.7°	127.0°
C8	N3	N2	109.7°	108.8°
N1	C7	H7	127.6°	127.0°
C7	N1	N2	109.9°	108.5°
C7	N1	C1	130.5°	125.7°
N3	N2	N1	110.5°	110.5°
N2	N1	C1	119.5°	125.7°
N1	C1	C2	119.1°	109.4°
N1	C1	O5	106.9°	109.5°
N1	C1	H1	103.7°	109.5°
C2	C1	O5	106.2°	109.4°
C2	C1	H1	104.4°	109.5°
C1	C2	C3	109.7°	109.1°
C1	C2	O2	110.2°	109.5°
C1	C2	H2	109.5°	109.5°
O5	C1	H1	117.2°	109.6°
C1	O5	C5	109.2°	114.1°
O5	C5	C4	111.2°	109.4°
O5	C5	C6	107.4°	109.5°
O5	C5	H5	111.0°	109.4°
C4	C5	C6	113.0°	109.5°
C4	C5	H5	105.2°	109.4°
C5	C4	O4	109.0°	109.5°
C5	C4	C3	112.4°	109.2°
C5	C4	H4	107.8°	109.5°
C6	C5	H5	109.1°	109.5°
C5	C6	O6	110.0°	109.5°
C5	C6	H6	109.3°	109.5°
C5	C6	H6A	109.2°	109.5°
O6	C6	H6	109.3°	109.5°
O6	C6	H6A	109.2°	109.4°
C6	O6	HO6	109.5°	114.0°
H6	C6	H6A	109.9°	109.5°
O4	C4	C3	109.4°	109.6°
O4	C4	H4	110.8°	109.5°
C4	O4	HO4	109.5°	114.1°
C3	C4	H4	107.3°	109.5°
C4	C3	O3	109.7°	109.6°
C4	C3	C2	111.1°	109.0°
C4	C3	H3	108.7°	109.5°
O3	C3	C2	110.8°	109.5°
O3	C3	H3	108.9°	109.6°
C3	O3	HO3	109.5°	114.0°
C2	C3	H3	107.5°	109.6°
C3	C2	O2	111.5°	109.5°
C3	C2	H2	108.2°	109.5°
O2	C2	H2	107.7°	109.6°
C2	O2	HO2	109.5°	114.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C9	C10	C11	H10	180.0°	179.7°
C9	C10	C11	C16	0.0°	0.3°
C9	C10	C11	C12	180.0°	179.7°
C10	C9	C18	C17	0.1°	0.5°
C10	C9	C18	C8	180.0°	179.5°
C10	C9	C18	H18	179.8°	179.7°
C10	C9	C8	C7	174.8°	175.2°
C10	C9	C8	N3	4.8°	4.5°
C10	C11	C16	C12	180.0°	180.0°
C10	C11	C12	C13	180.0°	180.0°
C10	C11	C12	H12	0.0°	0.0°
C10	C11	C16	C15	179.8°	180.0°
C10	C11	C16	C17	0.1°	0.0°
C11	C10	C9	C18	0.1°	0.5°
C11	C10	C9	C8	179.9°	180.0°
H10	C10	C11	C16	180.0°	180.0°
H10	C10	C11	C12	0.0°	0.0°
H10	C10	C9	C18	179.9°	179.8°
H10	C10	C9	C8	0.1°	0.3°
C16	C11	C12	C13	0.0°	0.0°
C16	C11	C12	H12	180.0°	180.0°
C11	C16	C15	C14	0.2°	0.0°
C11	C16	C15	C17	179.7°	180.0°
C11	C16	C15	H15	179.8°	179.9°
C11	C16	C17	C18	0.2°	0.0°
C11	C16	C17	H17	179.8°	180.0°
C11	C12	C13	H12	180.0°	180.0°
C11	C12	C13	C14	0.2°	0.0°
C11	C12	C13	H13	179.8°	180.0°
C12	C11	C16	C15	0.2°	0.0°
C12	C11	C16	C17	179.9°	180.0°
C12	C13	C14	H13	180.0°	179.9°
C12	C13	C14	C15	0.2°	0.0°
C12	C13	C14	H14	179.8°	180.0°
H12	C12	C13	C14	179.8°	180.0°
H12	C12	C13	H13	0.2°	0.0°
C13	C14	C15	H14	180.0°	180.0°
C13	C14	C15	C16	0.0°	0.0°
C13	C14	C15	H15	180.0°	179.9°
H13	C13	C14	C15	179.8°	180.0°
H13	C13	C14	H14	0.2°	0.0°
C14	C15	C16	H15	180.0°	179.9°
C14	C15	C16	C17	179.9°	180.0°
H14	C14	C15	C16	180.0°	180.0°
H14	C14	C15	H15	0.0°	0.1°
C15	C16	C17	C18	179.9°	179.9°
C15	C16	C17	H17	0.1°	0.1°
H15	C15	C16	C17	0.1°	0.1°
C16	C17	C18	H17	180.0°	180.0°
C16	C17	C18	C9	0.2°	0.2°
C16	C17	C18	H18	179.8°	180.0°
C17	C18	C9	H18	180.0°	179.8°
C17	C18	C9	C8	179.8°	180.0°
H17	C17	C18	C9	179.8°	179.8°
H17	C17	C18	H18	0.2°	0.0°
C18	C9	C8	C7	5.2°	5.2°
C18	C9	C8	N3	175.2°	175.1°
H18	C18	C9	C8	0.2°	0.2°
C9	C8	C7	N3	179.7°	179.7°
C9	C8	C7	N1	179.5°	180.0°
C9	C8	C7	H7	0.5°	0.0°
C9	C8	N3	N2	179.9°	180.0°
C8	C7	N1	H7	180.0°	180.0°
C7	C8	N3	N2	0.3°	0.3°
C8	C7	N1	N2	1.0°	0.1°
C8	C7	N1	C1	179.0°	180.0°
N3	C8	C7	N1	0.8°	0.2°
N3	C8	C7	H7	179.2°	179.8°
C8	N3	N2	N1	0.3°	0.2°
C7	N1	N2	N3	0.8°	0.1°
C7	N1	N2	C1	178.3°	179.9°
C7	N1	C1	C2	43.9°	125.1°
C7	N1	C1	O5	76.3°	115.0°
C7	N1	C1	H1	159.3°	5.1°
H7	C7	N1	N2	179.0°	179.9°
H7	C7	N1	C1	1.0°	0.0°
N3	N2	N1	C1	179.1°	179.9°
N2	N1	C1	C2	138.2°	54.8°
N2	N1	C1	O5	101.7°	65.1°
N2	N1	C1	H1	22.8°	174.8°
N1	C1	C2	O5	120.5°	119.9°
N1	C1	C2	H1	115.0°	120.0°
N1	C1	O5	H1	115.7°	120.0°
N1	C1	O5	C5	160.1°	178.9°
N1	C1	C2	C3	174.5°	177.6°
N1	C1	C2	O2	51.4°	62.5°
N1	C1	C2	H2	66.9°	57.7°
C2	C1	O5	H1	116.1°	120.1°
C2	C1	O5	C5	71.7°	61.2°
C1	C2	C3	C4	51.3°	57.0°
C1	C2	C3	O3	173.5°	176.9°
C1	C2	C3	O2	122.4°	119.8°
C1	C2	C3	H2	119.4°	119.9°
C1	C2	C3	H3	67.5°	62.8°
C1	C2	O2	H2	119.4°	120.2°
C1	C2	O2	HO2	17.4°	179.6°
C1	O5	C5	C4	64.0°	61.1°
C1	O5	C5	C6	171.9°	178.8°
C1	O5	C5	H5	52.7°	58.7°
O5	C1	C2	C3	65.0°	57.7°
O5	C1	C2	O2	171.9°	177.5°
O5	C1	C2	H2	53.7°	62.2°
H1	C1	O5	C5	44.4°	58.8°
H1	C1	C2	C3	59.5°	62.4°
H1	C1	C2	O2	63.6°	57.4°
H1	C1	C2	H2	178.1°	177.7°
O5	C5	C4	C6	120.9°	120.0°
O5	C5	C4	H5	120.2°	119.9°
O5	C5	C6	H5	120.4°	120.0°
O5	C5	C6	O6	69.9°	65.0°
O5	C5	C6	H6	50.1°	175.0°
O5	C5	C6	H6A	170.3°	55.0°
O5	C5	C4	O4	170.4°	177.6°
O5	C5	C4	C3	48.8°	57.6°
O5	C5	C4	H4	69.3°	62.3°
C4	C5	C6	H5	116.6°	120.0°
C4	C5	C6	O6	53.1°	175.1°
C4	C5	C6	H6	173.1°	55.0°
C4	C5	C6	H6A	66.7°	65.0°
C5	C4	O4	C3	123.3°	119.8°
C5	C4	O4	H4	118.5°	120.1°
C5	C4	C3	H4	118.3°	119.9°
C5	C4	O4	HO4	13.6°	180.0°
C5	C4	C3	O3	165.8°	176.8°
C5	C4	C3	C2	42.9°	57.0°
C5	C4	C3	H3	75.2°	62.9°
C5	C6	O6	H6	120.0°	120.0°
C5	C6	O6	H6A	119.8°	120.0°
C5	C6	H6	H6A	119.8°	120.0°
C5	C6	O6	HO6	74.2°	180.0°
C6	C5	C4	O4	68.8°	62.4°
C6	C5	C4	C3	169.7°	177.6°
C6	C5	C4	H4	51.6°	57.7°
H5	C5	C6	O6	169.7°	55.0°
H5	C5	C6	H6	70.3°	65.0°
H5	C5	C6	H6A	49.9°	175.0°
H5	C5	C4	O4	50.1°	57.7°
H5	C5	C4	C3	71.4°	62.3°
H5	C5	C4	H4	170.5°	177.8°
O6	C6	H6	H6A	119.8°	120.0°
H6	C6	O6	HO6	165.9°	60.0°
H6A	C6	O6	HO6	45.6°	60.0°
O4	C4	C3	H4	120.3°	120.1°
O4	C4	C3	O3	72.9°	63.2°
O4	C4	C3	C2	164.2°	176.9°
O4	C4	C3	H3	46.1°	57.1°
C3	C4	O4	HO4	109.7°	60.3°
C4	C3	O3	C2	123.1°	119.5°
C4	C3	O3	H3	118.8°	120.2°
C4	C3	C2	H3	118.8°	119.8°
C4	C3	O3	HO3	84.7°	180.0°
C4	C3	C2	O2	173.6°	176.8°
C4	C3	C2	H2	68.2°	62.9°
H4	C4	O4	HO4	132.1°	59.9°
H4	C4	C3	O3	47.5°	56.9°
H4	C4	C3	C2	75.5°	62.9°
H4	C4	C3	H3	166.5°	177.2°
O3	C3	C2	H3	118.9°	120.3°
O3	C3	C2	O2	64.1°	63.3°
O3	C3	C2	H2	54.1°	56.9°
C2	C3	O3	HO3	152.3°	60.4°
C3	C2	O2	H2	118.5°	120.2°
C3	C2	O2	HO2	139.5°	60.0°
H3	C3	O3	HO3	34.2°	59.8°
H3	C3	C2	O2	54.8°	57.0°
H3	C3	C2	H2	173.1°	177.2°
H2	C2	O2	HO2	102.0°	60.2°

Definition date:	2009-02-05
Last modified:	2011-06-04
Release status:	REL
Processing site:	RCSB
Derived from:	3G2K