C3G

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O3	C3	sing	1.43Å	1.47Å
O2	C2	sing	1.43Å	1.47Å
C2	C3	sing	1.53Å	1.47Å
C2	C1	sing	1.53Å	1.55Å
C3	C4	sing	1.53Å	1.49Å
C4	O4	sing	1.43Å	1.39Å
C4	C5	sing	1.53Å	1.55Å
O1	C1	sing	1.43Å	1.52Å
O1	C14	sing	1.36Å	1.41Å
C1	O5	sing	1.43Å	1.48Å
O5	C5	sing	1.43Å	1.47Å
C14	C15	doub	1.39Å	1.43Å	Aromatic
C14	C19	sing	1.39Å	1.40Å	Aromatic
C5	C6	sing	1.51Å	1.52Å
C15	C16	sing	1.38Å	1.40Å	Aromatic
C6	O6A	doub	1.21Å	1.24Å
C6	O6B	sing	1.34Å	1.32Å
C19	C18	doub	1.38Å	1.39Å	Aromatic
C16	C17	doub	1.38Å	1.38Å	Aromatic
C18	C17	sing	1.38Å	1.44Å	Aromatic
C17	N20	sing	1.48Å	1.43Å
N20	O21	doub	1.22Å	1.46Å
N20	O22	sing	1.22Å	1.15Å
C15	H1A	sing	1.08Å	1.08Å
C3	H3	sing	1.09Å	1.10Å
C2	H2	sing	1.09Å	1.10Å
C1	H1	sing	1.09Å	1.10Å
C5	H5	sing	1.09Å	1.10Å
C4	H4	sing	1.09Å	1.10Å
C16	H7	sing	1.08Å	1.08Å
C18	H8	sing	1.08Å	1.08Å
C19	H9	sing	1.08Å	1.08Å
O3	HO3	sing	0.97Å	0.95Å
O2	HO2	sing	0.97Å	0.95Å
O4	HO4	sing	0.97Å	0.95Å
O6B	HO6B	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O3	C3	C2	109.3°	109.6°
O3	C3	C4	109.5°	109.5°
O3	C3	H3	108.8°	109.6°
C3	O3	HO3	109.5°	114.0°
O2	C2	C3	109.6°	109.5°
O2	C2	C1	108.7°	109.5°
O2	C2	H2	109.2°	109.6°
C2	O2	HO2	109.5°	114.0°
C3	C2	C1	112.0°	109.2°
C2	C3	C4	111.7°	109.0°
C2	C3	H3	108.8°	109.5°
C3	C2	H2	109.1°	109.5°
C2	C1	O1	108.1°	109.5°
C2	C1	O5	111.9°	109.4°
C1	C2	H2	108.1°	109.5°
C2	C1	H1	108.6°	109.5°
C3	C4	O4	109.2°	109.5°
C3	C4	C5	110.7°	109.2°
C4	C3	H3	108.6°	109.5°
C3	C4	H4	109.0°	109.5°
O4	C4	C5	109.3°	109.5°
O4	C4	H4	110.3°	109.5°
C4	O4	HO4	109.5°	114.0°
C4	C5	O5	111.3°	109.4°
C4	C5	C6	110.2°	109.5°
C4	C5	H5	108.2°	109.4°
C5	C4	H4	108.2°	109.5°
C1	O1	C14	111.3°	117.0°
O1	C1	O5	109.7°	109.5°
O1	C1	H1	108.9°	109.6°
O1	C14	C15	120.3°	120.1°
O1	C14	C19	119.9°	120.0°
C1	O5	C5	112.0°	114.1°
O5	C1	H1	109.5°	109.4°
O5	C5	C6	109.4°	109.5°
O5	C5	H5	109.2°	109.5°
C15	C14	C19	119.8°	119.9°
C14	C15	C16	120.0°	119.9°
C14	C15	H1A	120.0°	120.1°
C14	C19	C18	120.0°	119.9°
C14	C19	H9	120.0°	120.1°
C5	C6	O6A	120.0°	120.0°
C5	C6	O6B	119.9°	120.0°
C6	C5	H5	108.5°	109.5°
C15	C16	C17	120.1°	120.1°
C16	C15	H1A	120.0°	120.0°
C15	C16	H7	119.9°	120.0°
O6A	C6	O6B	120.1°	120.0°
C6	O6B	HO6B	109.5°	117.0°
C19	C18	C17	120.0°	120.1°
C19	C18	H8	120.0°	119.9°
C18	C19	H9	120.0°	120.0°
C16	C17	C18	120.1°	120.1°
C16	C17	N20	119.8°	119.9°
C17	C16	H7	120.0°	119.9°
C18	C17	N20	120.1°	119.9°
C17	C18	H8	120.0°	120.0°
C17	N20	O21	119.7°	120.0°
C17	N20	O22	120.2°	120.0°
O21	N20	O22	120.1°	120.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O3	C3	C2	O2	64.1°	63.2°
O3	C3	C2	C4	121.4°	119.9°
O3	C3	C2	H3	118.7°	120.3°
O3	C3	C2	C1	175.1°	176.9°
O3	C3	C4	H3	118.8°	120.2°
O3	C3	C4	O4	62.8°	63.1°
O3	C3	C4	C5	176.8°	176.9°
O3	C3	C2	H2	55.4°	57.0°
O3	C3	C4	H4	57.8°	57.0°
O2	C2	C3	C1	120.7°	119.9°
O2	C2	C3	H2	119.6°	120.2°
O2	C2	C1	H2	118.4°	120.2°
O2	C2	C3	C4	174.5°	176.9°
O2	C2	C1	O1	65.5°	62.5°
O2	C2	C1	O5	173.5°	177.5°
O2	C2	C3	H3	54.6°	57.1°
O2	C2	C1	H1	52.5°	57.6°
C3	C2	C1	H2	120.3°	119.9°
C2	C3	C4	H3	120.0°	119.8°
C2	C3	C4	O4	176.0°	176.9°
C2	C3	C4	C5	55.6°	56.9°
C3	C2	C1	O1	173.2°	177.6°
C3	C2	C1	O5	52.2°	57.6°
C3	C2	C1	H1	68.8°	62.3°
C2	C3	C4	H4	63.4°	63.0°
C2	C3	O3	HO3	180.0°	60.4°
C3	C2	O2	HO2	180.0°	180.0°
C1	C2	C3	C4	53.8°	56.9°
C2	C1	O1	O5	122.3°	119.9°
C2	C1	O1	H1	117.8°	120.0°
C2	C1	O1	C14	166.5°	175.0°
C2	C1	O5	H1	120.5°	119.9°
C2	C1	O5	C5	53.0°	61.1°
C1	C2	C3	H3	66.1°	62.8°
C1	C2	O2	HO2	57.3°	60.3°
C3	C4	O4	C5	121.3°	119.7°
C3	C4	O4	H4	119.8°	120.1°
C3	C4	C5	H4	119.4°	119.9°
C3	C4	C5	O5	56.2°	57.6°
C3	C4	C5	C6	177.8°	177.6°
C4	C3	C2	H2	65.9°	63.0°
C3	C4	C5	H5	63.7°	62.4°
C4	C3	O3	HO3	57.4°	180.0°
C3	C4	O4	HO4	158.8°	179.9°
O4	C4	C5	H4	120.2°	120.2°
O4	C4	C5	O5	176.6°	177.5°
O4	C4	C5	C6	61.8°	62.5°
O4	C4	C3	H3	56.0°	57.1°
O4	C4	C5	H5	56.6°	57.5°
C4	C5	O5	C1	55.2°	61.1°
C4	C5	O5	C6	122.0°	120.0°
C4	C5	O5	H5	119.3°	119.9°
C4	C5	C6	H5	118.3°	120.0°
C4	C5	C6	O6A	47.6°	115.0°
C4	C5	C6	O6B	132.9°	65.3°
C5	C4	C3	H3	64.4°	62.9°
C5	C4	O4	HO4	37.5°	60.3°
O1	C1	O5	H1	119.5°	120.1°
O1	C1	O5	C5	173.0°	178.9°
C1	O1	C14	C15	98.8°	180.0°
C1	O1	C14	C19	81.8°	0.0°
O1	C1	C2	H2	52.9°	57.7°
C14	O1	C1	O5	71.2°	65.1°
O1	C14	C15	C19	179.4°	179.9°
O1	C14	C15	C16	179.6°	180.0°
O1	C14	C19	C18	179.7°	180.0°
O1	C14	C15	H1A	0.4°	0.2°
C14	O1	C1	H1	48.7°	54.9°
O1	C14	C19	H9	0.3°	0.1°
C1	O5	C5	C6	177.2°	178.8°
O5	C1	C2	H2	68.1°	62.3°
C1	O5	C5	H5	64.2°	58.8°
O5	C5	C6	H5	119.1°	120.0°
O5	C5	C6	O6A	170.3°	5.0°
O5	C5	C6	O6B	10.2°	174.8°
C5	O5	C1	H1	67.5°	58.8°
O5	C5	C4	H4	63.2°	62.3°
C14	C15	C16	H1A	180.0°	179.7°
C15	C14	C19	C18	0.3°	0.1°
C14	C15	C16	C17	0.0°	0.2°
C14	C15	C16	H7	179.9°	179.8°
C15	C14	C19	H9	179.6°	180.0°
C19	C14	C15	C16	0.2°	0.0°
C14	C19	C18	H9	180.0°	179.9°
C14	C19	C18	C17	0.3°	0.2°
C19	C14	C15	H1A	179.8°	179.7°
C14	C19	C18	H8	179.7°	179.7°
C5	C6	O6A	O6B	179.5°	179.8°
C6	C5	C4	H4	58.4°	57.6°
C5	C6	O6B	HO6B	179.4°	179.7°
C15	C16	C17	H7	180.0°	180.0°
C15	C16	C17	C18	0.1°	0.5°
C15	C16	C17	N20	179.9°	180.0°
O6A	C6	C5	H5	70.6°	125.0°
O6A	C6	O6B	HO6B	0.0°	0.1°
O6B	C6	C5	H5	108.8°	54.7°
C19	C18	C17	C16	0.1°	0.4°
C19	C18	C17	H8	180.0°	179.9°
C19	C18	C17	N20	180.0°	180.0°
C16	C17	C18	N20	180.0°	179.5°
C16	C17	N20	O21	1.9°	0.0°
C16	C17	N20	O22	178.3°	180.0°
C17	C16	C15	H1A	180.0°	180.0°
C16	C17	C18	H8	179.9°	179.5°
C18	C17	N20	O21	178.0°	179.5°
C18	C17	N20	O22	1.7°	0.5°
C18	C17	C16	H7	180.0°	179.6°
C17	C18	C19	H9	179.7°	179.7°
C17	N20	O21	O22	179.8°	180.0°
N20	C17	C16	H7	0.1°	0.1°
N20	C17	C18	H8	0.1°	0.0°
H1A	C15	C16	H7	0.1°	0.1°
H3	C3	C2	H2	174.2°	177.3°
H3	C3	C4	H4	176.6°	177.2°
H3	C3	O3	HO3	61.2°	59.8°
H2	C2	C1	H1	170.9°	177.8°
H2	C2	O2	HO2	60.5°	59.9°
H5	C5	C4	H4	176.9°	177.7°
H4	C4	O4	HO4	81.4°	59.9°
H8	C18	C19	H9	0.3°	0.4°

Release date:	2017-12-20
Definition date:	2017-09-11
Last modified:	2020-07-17
Release status:	REL
Processing site:	RCSB
Derived from:	6AYI