TVY

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O6	C6	sing	1.43Å	1.41Å
C6	C5	sing	1.53Å	1.53Å
N17	C15	sing	1.47Å	1.46Å
C15	C13	sing	1.53Å	1.54Å
C5	O5	sing	1.43Å	1.41Å
C5	C4	sing	1.53Å	1.53Å
O4	C4	sing	1.43Å	1.42Å
O5	C1	sing	1.43Å	1.42Å
C4	C3	sing	1.53Å	1.55Å
C13	C9	sing	1.51Å	1.51Å
C13	O1	sing	1.43Å	1.41Å
C8	C9	doub	1.38Å	1.39Å	Aromatic
C8	C7	sing	1.38Å	1.39Å	Aromatic
C1	O1	sing	1.43Å	1.41Å
C1	C2	sing	1.53Å	1.54Å
C9	C10	sing	1.38Å	1.39Å	Aromatic
C7	C12	doub	1.38Å	1.39Å	Aromatic
C3	C2	sing	1.53Å	1.54Å
C3	O3	sing	1.43Å	1.42Å
C2	O2	sing	1.43Å	1.41Å
C10	C11	doub	1.38Å	1.39Å	Aromatic
C12	C11	sing	1.38Å	1.39Å	Aromatic
C7	H11	sing	1.08Å	1.08Å
C8	H12	sing	1.08Å	1.08Å
C10	H13	sing	1.08Å	1.08Å
C11	H14	sing	1.08Å	1.08Å
C12	H15	sing	1.08Å	1.08Å
C13	H6	sing	1.09Å	1.10Å
C15	H7	sing	1.09Å	1.10Å
C15	H8	sing	1.09Å	1.10Å
N17	H9	sing	1.01Å	1.00Å
N17	H10	sing	1.01Å	1.00Å
C1	H1	sing	1.09Å	1.10Å
C5	H5	sing	1.09Å	1.10Å
C4	H4	sing	1.09Å	1.10Å
C2	H2	sing	1.09Å	1.10Å
C3	H3	sing	1.09Å	1.10Å
C6	H61	sing	1.09Å	1.10Å
C6	H62	sing	1.09Å	1.10Å
O2	HO2	sing	0.97Å	0.95Å
O3	HO3	sing	0.97Å	0.95Å
O4	HO4	sing	0.97Å	0.95Å
O6	HO6	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O6	C6	C5	108.2°	109.5°
O6	C6	H61	109.8°	109.5°
O6	C6	H62	109.8°	109.4°
C6	O6	HO6	109.5°	114.0°
C6	C5	O5	107.5°	109.5°
C6	C5	C4	113.5°	109.5°
C6	C5	H5	109.1°	109.5°
C5	C6	H61	109.8°	109.5°
C5	C6	H62	109.8°	109.5°
N17	C15	C13	113.2°	109.5°
N17	C15	H7	108.5°	109.5°
N17	C15	H8	108.5°	109.5°
C15	N17	H9	109.5°	111.0°
C15	N17	H10	109.4°	111.0°
C15	C13	C9	111.0°	109.5°
C15	C13	O1	109.3°	109.5°
C15	C13	H6	108.6°	109.5°
C13	C15	H7	108.5°	109.5°
C13	C15	H8	108.5°	109.5°
O5	C5	C4	107.0°	109.4°
C5	O5	C1	118.4°	114.1°
O5	C5	H5	110.7°	109.4°
C5	C4	O4	110.7°	109.5°
C5	C4	C3	110.0°	109.2°
C4	C5	H5	109.0°	109.5°
C5	C4	H4	107.8°	109.5°
O4	C4	C3	111.3°	109.5°
O4	C4	H4	109.3°	109.6°
C4	O4	HO4	109.5°	114.0°
O5	C1	O1	108.5°	109.5°
O5	C1	C2	112.9°	109.4°
O5	C1	H1	109.4°	109.5°
C4	C3	C2	112.0°	109.0°
C4	C3	O3	111.7°	109.6°
C3	C4	H4	107.6°	109.5°
C4	C3	H3	108.8°	109.6°
C9	C13	O1	108.6°	109.5°
C13	C9	C8	120.6°	120.0°
C13	C9	C10	120.5°	120.0°
C9	C13	H6	109.0°	109.4°
C13	O1	C1	116.5°	114.0°
O1	C13	H6	110.4°	109.5°
C9	C8	C7	120.7°	120.0°
C8	C9	C10	118.9°	120.0°
C9	C8	H12	119.7°	119.9°
C8	C7	C12	120.0°	120.0°
C8	C7	H11	120.0°	120.0°
C7	C8	H12	119.7°	120.0°
O1	C1	C2	108.7°	109.5°
O1	C1	H1	109.5°	109.5°
C1	C2	C3	112.9°	109.2°
C1	C2	O2	113.9°	109.6°
C2	C1	H1	107.8°	109.5°
C1	C2	H2	106.6°	109.5°
C9	C10	C11	120.7°	120.0°
C9	C10	H13	119.7°	120.1°
C7	C12	C11	119.8°	120.0°
C12	C7	H11	120.0°	120.0°
C7	C12	H15	120.1°	120.0°
C2	C3	O3	104.9°	109.6°
C3	C2	O2	108.4°	109.5°
C3	C2	H2	106.6°	109.5°
C2	C3	H3	108.9°	109.5°
O3	C3	H3	110.5°	109.6°
C3	O3	HO3	109.5°	114.0°
O2	C2	H2	108.2°	109.5°
C2	O2	HO2	109.5°	114.0°
C10	C11	C12	120.0°	120.0°
C11	C10	H13	119.6°	119.9°
C10	C11	H14	120.0°	120.0°
C12	C11	H14	120.0°	120.0°
C11	C12	H15	120.1°	120.0°
H7	C15	H8	109.5°	109.5°
H9	N17	H10	109.5°	111.0°
H61	C6	H62	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O6	C6	C5	H61	119.8°	120.0°
O6	C6	C5	H62	119.8°	120.0°
O6	C6	C5	O5	62.5°	63.3°
O6	C6	C5	C4	179.4°	176.8°
O6	C6	C5	H5	57.6°	56.7°
O6	C6	H61	H62	120.6°	120.0°
C6	C5	O5	C4	122.3°	120.0°
C6	C5	O5	H5	119.0°	120.0°
C6	C5	C4	H5	121.8°	120.1°
C6	C5	C4	O4	52.7°	62.5°
C6	C5	O5	C1	176.9°	178.8°
C6	C5	C4	C3	176.2°	177.6°
C6	C5	C4	H4	66.8°	57.7°
C5	C6	H61	H62	120.6°	120.0°
C5	C6	O6	HO6	180.0°	180.0°
N17	C15	C13	H7	120.6°	120.0°
N17	C15	C13	H8	120.6°	120.0°
N17	C15	C13	C9	61.4°	169.1°
N17	C15	C13	O1	178.9°	70.8°
N17	C15	C13	H6	58.5°	49.2°
N17	C15	H7	H8	118.3°	120.0°
C15	N17	H9	H10	120.0°	124.0°
C15	C13	C9	O1	120.1°	120.0°
C15	C13	C9	H6	119.6°	120.0°
C15	C13	O1	H6	119.4°	120.0°
C15	C13	C9	C8	94.5°	100.0°
C15	C13	O1	C1	99.7°	151.0°
C15	C13	C9	C10	85.3°	80.1°
C13	C15	H7	H8	118.3°	120.0°
C13	C15	N17	H9	180.0°	48.8°
C13	C15	N17	H10	60.0°	172.8°
O5	C5	C4	H5	119.7°	119.9°
O5	C5	C4	O4	171.1°	177.5°
O5	C5	C4	C3	65.4°	57.6°
C5	O5	C1	O1	121.7°	58.8°
C5	O5	C1	C2	1.1°	61.2°
C5	O5	C1	H1	118.9°	178.8°
O5	C5	C4	H4	51.6°	62.3°
O5	C5	C6	H61	57.3°	176.7°
O5	C5	C6	H62	177.8°	56.7°
C5	C4	O4	C3	122.7°	119.7°
C5	C4	O4	H4	118.6°	120.1°
C4	C5	O5	C1	54.7°	61.2°
C5	C4	C3	H4	117.1°	119.9°
C5	C4	C3	C2	21.0°	57.0°
C5	C4	C3	O3	138.3°	176.9°
C5	C4	C3	H3	99.4°	62.8°
C4	C5	C6	H61	60.8°	56.8°
C4	C5	C6	H62	59.7°	63.2°
C5	C4	O4	HO4	180.0°	180.0°
O4	C4	C3	H4	119.7°	120.2°
O4	C4	C3	C2	144.1°	176.9°
O4	C4	C3	O3	98.5°	63.2°
O4	C4	C5	H5	69.2°	57.6°
O4	C4	C3	H3	23.7°	57.1°
O5	C1	O1	C13	48.1°	68.6°
O5	C1	O1	C2	123.2°	119.9°
O5	C1	O1	H1	119.3°	120.0°
O5	C1	C2	H1	120.9°	120.0°
O5	C1	C2	C3	46.8°	57.6°
O5	C1	C2	O2	171.0°	62.3°
C1	O5	C5	H5	64.0°	58.8°
O5	C1	C2	H2	69.9°	177.6°
C4	C3	C2	C1	32.6°	57.0°
C4	C3	C2	O3	121.3°	119.9°
C4	C3	C2	H3	120.4°	119.9°
C4	C3	O3	H3	121.2°	120.3°
C4	C3	C2	O2	159.7°	63.0°
C3	C4	C5	H5	54.3°	62.3°
C4	C3	C2	H2	84.0°	176.9°
C4	C3	O3	HO3	180.0°	180.0°
C3	C4	O4	HO4	57.3°	60.3°
C9	C13	O1	H6	119.4°	120.0°
C13	C9	C8	C10	179.8°	179.9°
C13	C9	C8	C7	179.8°	180.0°
C9	C13	O1	C1	139.1°	89.0°
C13	C9	C10	C11	179.9°	180.0°
C13	C9	C8	H12	0.2°	0.1°
C13	C9	C10	H13	0.1°	0.0°
C9	C13	C15	H7	178.1°	49.2°
C9	C13	C15	H8	59.2°	70.8°
O1	C13	C9	C8	145.3°	139.9°
C13	O1	C1	C2	171.2°	171.4°
O1	C13	C9	C10	34.9°	40.0°
O1	C13	C15	H7	58.4°	169.2°
O1	C13	C15	H8	60.5°	49.2°
C13	O1	C1	H1	71.2°	51.3°
C9	C8	C7	H12	180.0°	179.9°
C9	C8	C7	C12	0.0°	0.1°
C8	C9	C10	C11	0.1°	0.1°
C9	C8	C7	H11	180.0°	179.7°
C8	C9	C10	H13	179.9°	179.9°
C8	C9	C13	H6	25.1°	19.9°
C7	C8	C9	C10	0.0°	0.1°
C8	C7	C12	H11	180.0°	179.8°
C8	C7	C12	C11	0.0°	0.1°
C8	C7	C12	H15	180.0°	179.8°
O1	C1	C2	H1	118.6°	120.0°
O1	C1	C2	C3	167.3°	62.3°
O1	C1	C2	O2	68.6°	177.7°
C1	O1	C13	H6	19.7°	31.0°
O1	C1	C2	H2	50.6°	57.6°
C1	C2	C3	O2	127.1°	120.0°
C1	C2	C3	H2	116.7°	119.9°
C1	C2	C3	O3	88.7°	176.9°
C1	C2	O2	H2	118.3°	120.1°
C1	C2	C3	H3	153.0°	62.9°
C1	C2	O2	HO2	180.0°	59.9°
C9	C10	C11	H13	180.0°	179.9°
C9	C10	C11	C12	0.1°	0.1°
C10	C9	C8	H12	180.0°	180.0°
C9	C10	C11	H14	179.9°	180.0°
C10	C9	C13	H6	155.1°	160.0°
C7	C12	C11	C10	0.0°	0.1°
C7	C12	C11	H15	180.0°	179.7°
C12	C7	C8	H12	180.0°	180.0°
C7	C12	C11	H14	180.0°	180.0°
C2	C3	O3	H3	117.2°	120.2°
C3	C2	O2	H2	115.2°	120.2°
C3	C2	C1	H1	74.1°	177.6°
C2	C3	C4	H4	96.1°	62.9°
C3	C2	O2	HO2	53.5°	179.6°
C2	C3	O3	HO3	58.5°	60.4°
O3	C3	C2	O2	38.4°	56.9°
O3	C3	C4	H4	21.2°	57.0°
O3	C3	C2	H2	154.6°	63.2°
O2	C2	C1	H1	50.0°	57.6°
O2	C2	C3	H3	79.9°	177.2°
C10	C11	C12	H14	180.0°	179.9°
C10	C11	C12	H15	180.0°	179.8°
C11	C12	C7	H11	180.0°	179.7°
C12	C11	C10	H13	179.9°	179.9°
H11	C7	C8	H12	0.0°	0.2°
H11	C7	C12	H15	0.0°	0.1°
H13	C10	C11	H14	0.1°	0.1°
H14	C11	C12	H15	0.0°	0.3°
H6	C13	C15	H7	62.1°	70.8°
H6	C13	C15	H8	179.0°	169.2°
H7	C15	N17	H9	59.5°	71.2°
H7	C15	N17	H10	60.6°	52.8°
H8	C15	N17	H9	59.5°	168.8°
H8	C15	N17	H10	179.5°	67.2°
H1	C1	C2	H2	169.2°	62.5°
H5	C5	C4	H4	171.3°	177.8°
H5	C5	C6	H61	177.4°	63.3°
H5	C5	C6	H62	62.2°	176.7°
H4	C4	C3	H3	143.4°	177.2°
H4	C4	O4	HO4	61.4°	59.8°
H2	C2	C3	H3	36.3°	57.0°
H2	C2	O2	HO2	61.7°	60.2°
H3	C3	O3	HO3	58.8°	59.7°
H61	C6	O6	HO6	60.2°	60.0°
H62	C6	O6	HO6	60.2°	60.0°

Release date:	2020-07-29
Definition date:	2020-04-01
Last modified:	2020-07-17
Release status:	REL
Processing site:	RCSB
Derived from:	2QJE