ZK8

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C05	C06	sing	1.53Å	1.52Å
C05	C04	sing	1.53Å	1.54Å
O01	P01	sing	1.61Å	1.46Å
C02	C01	sing	1.53Å	1.53Å
C02	C03	sing	1.53Å	1.54Å
C01	P01	sing	1.82Å	1.86Å
C03	C04	sing	1.53Å	1.53Å
O02	C14	sing	1.36Å	1.39Å
P01	O03	sing	1.61Å	1.68Å
C14	C15	doub	1.39Å	1.43Å	Aromatic
C14	C13	sing	1.40Å	1.44Å	Aromatic
O03	C07	sing	1.36Å	1.42Å
C15	C16	sing	1.39Å	1.37Å	Aromatic
C07	C12	doub	1.39Å	1.43Å	Aromatic
C07	C08	sing	1.40Å	1.46Å	Aromatic
C12	C11	sing	1.39Å	1.40Å	Aromatic
C13	C08	sing	1.48Å	1.54Å
C13	N02	doub	1.33Å	1.34Å	Aromatic
C16	C17	doub	1.38Å	1.34Å	Aromatic
C08	N01	doub	1.33Å	1.33Å	Aromatic
C11	C10	doub	1.38Å	1.34Å	Aromatic
N01	C10	sing	1.32Å	1.28Å	Aromatic
N02	C17	sing	1.32Å	1.29Å	Aromatic
C10	H1	sing	1.08Å	1.08Å
C11	H2	sing	1.08Å	1.08Å
C12	H3	sing	1.08Å	1.08Å
C15	H4	sing	1.08Å	1.08Å
C16	H5	sing	1.08Å	1.08Å
C17	H6	sing	1.08Å	1.08Å
C01	H7	sing	1.09Å	1.10Å
C01	H8	sing	1.09Å	1.10Å
O01	H9	sing	0.97Å	0.95Å
C02	H10	sing	1.09Å	1.10Å
C02	H11	sing	1.09Å	1.10Å
O02	H12	sing	0.97Å	0.95Å
C03	H13	sing	1.09Å	1.10Å
C03	H14	sing	1.09Å	1.10Å
C04	H15	sing	1.09Å	1.10Å
C04	H16	sing	1.09Å	1.10Å
C05	H17	sing	1.09Å	1.10Å
C05	H18	sing	1.09Å	1.10Å
C06	H19	sing	1.09Å	1.10Å
C06	H20	sing	1.09Å	1.10Å
C06	H21	sing	1.09Å	1.10Å
P01	O1	doub	1.48Å	1.63Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C06	C05	C04	109.7°	109.5°
C06	C05	H17	109.4°	109.4°
C06	C05	H18	109.4°	109.5°
C05	C06	H19	109.5°	109.5°
C05	C06	H20	109.5°	109.5°
C05	C06	H21	109.5°	109.5°
C05	C04	C03	110.2°	109.5°
C05	C04	H15	109.3°	109.5°
C05	C04	H16	109.3°	109.5°
C04	C05	H17	109.4°	109.5°
C04	C05	H18	109.4°	109.5°
O01	P01	C01	109.3°	109.4°
O01	P01	O03	104.8°	109.5°
P01	O01	H9	109.5°	114.0°
O01	P01	O1	110.1°	109.5°
C01	C02	C03	113.5°	109.5°
C02	C01	P01	107.8°	109.5°
C02	C01	H7	109.9°	109.4°
C02	C01	H8	109.9°	109.5°
C01	C02	H10	108.4°	109.5°
C01	C02	H11	108.5°	109.5°
C02	C03	C04	112.0°	109.5°
C03	C02	H10	108.4°	109.4°
C03	C02	H11	108.4°	109.5°
C02	C03	H13	108.8°	109.4°
C02	C03	H14	108.8°	109.5°
C01	P01	O03	107.1°	109.5°
P01	C01	H7	109.9°	109.5°
P01	C01	H8	109.9°	109.5°
C01	P01	O1	108.4°	109.5°
C04	C03	H13	108.8°	109.5°
C04	C03	H14	108.9°	109.5°
C03	C04	H15	109.3°	109.4°
C03	C04	H16	109.3°	109.5°
O02	C14	C15	121.0°	120.5°
O02	C14	C13	120.3°	120.5°
C14	O02	H12	109.5°	114.0°
P01	O03	C07	128.4°	114.0°
O03	P01	O1	116.9°	109.5°
C15	C14	C13	118.7°	118.9°
C14	C15	C16	119.3°	118.5°
C14	C15	H4	120.4°	120.7°
C14	C13	C08	125.8°	119.8°
C14	C13	N02	114.7°	120.5°
O03	C07	C12	120.8°	120.5°
O03	C07	C08	122.3°	120.5°
C15	C16	C17	118.8°	119.4°
C16	C15	H4	120.3°	120.8°
C15	C16	H5	120.6°	120.3°
C12	C07	C08	116.9°	118.9°
C07	C12	C11	118.9°	118.5°
C07	C12	H3	120.5°	120.8°
C07	C08	C13	127.3°	119.8°
C07	C08	N01	116.1°	120.5°
C12	C11	C10	120.5°	119.4°
C12	C11	H2	119.7°	120.3°
C11	C12	H3	120.5°	120.8°
C08	C13	N02	119.5°	119.7°
C13	C08	N01	116.6°	119.7°
C13	N02	C17	126.7°	121.6°
C16	C17	N02	121.9°	121.1°
C17	C16	H5	120.6°	120.3°
C16	C17	H6	119.1°	119.5°
C08	N01	C10	127.5°	121.7°
C11	C10	N01	120.1°	121.0°
C11	C10	H1	119.9°	119.5°
C10	C11	H2	119.8°	120.3°
N01	C10	H1	119.9°	119.5°
N02	C17	H6	119.1°	119.5°
H7	C01	H8	109.5°	109.5°
H10	C02	H11	109.5°	109.4°
H13	C03	H14	109.5°	109.4°
H15	C04	H16	109.5°	109.5°
H17	C05	H18	109.5°	109.5°
H19	C06	H20	109.4°	109.5°
H19	C06	H21	109.4°	109.4°
H20	C06	H21	109.5°	109.4°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C06	C05	C04	H17	120.1°	119.9°
C06	C05	C04	H18	120.0°	120.0°
C06	C05	C04	C03	166.3°	NaN°
C06	C05	C04	H15	46.2°	60.0°
C06	C05	C04	H16	73.6°	60.0°
C06	C05	H17	H18	119.9°	120.0°
C05	C06	H19	H20	120.0°	120.0°
C05	C06	H19	H21	120.0°	120.0°
C05	C06	H20	H21	120.0°	120.0°
C05	C04	C03	C02	71.1°	180.0°
C05	C04	C03	H15	120.1°	120.0°
C05	C04	C03	H16	120.1°	120.0°
C05	C04	C03	H13	49.3°	60.1°
C05	C04	C03	H14	168.5°	59.9°
C05	C04	H15	H16	119.7°	120.0°
C04	C05	H17	H18	119.9°	120.1°
C04	C05	C06	H19	180.0°	179.9°
C04	C05	C06	H20	60.0°	60.0°
C04	C05	C06	H21	60.0°	59.9°
O01	P01	C01	C02	55.5°	65.0°
O01	P01	C01	O03	113.0°	120.0°
O01	P01	C01	O1	120.0°	120.0°
O01	P01	O03	O1	122.2°	120.0°
O01	P01	O03	C07	70.0°	65.0°
O01	P01	C01	H7	175.2°	175.0°
O01	P01	C01	H8	64.2°	55.0°
C01	C02	C03	H10	120.6°	120.0°
C01	C02	C03	H11	120.6°	120.0°
C02	C01	P01	H7	119.7°	120.0°
C02	C01	P01	H8	119.7°	120.0°
C01	C02	C03	C04	143.8°	180.0°
C02	C01	P01	O03	57.5°	175.0°
C02	C01	H7	H8	120.8°	120.0°
C01	C02	H10	H11	118.2°	120.0°
C01	C02	C03	H13	95.8°	60.0°
C01	C02	C03	H14	23.4°	60.0°
C02	C01	P01	O1	175.5°	55.0°
C03	C02	C01	P01	126.3°	180.0°
C02	C03	C04	H13	120.4°	120.0°
C02	C03	C04	H14	120.4°	120.0°
C03	C02	C01	H7	6.6°	60.0°
C03	C02	C01	H8	114.0°	60.0°
C03	C02	H10	H11	118.1°	119.9°
C02	C03	H13	H14	118.8°	119.9°
C02	C03	C04	H15	49.0°	60.0°
C02	C03	C04	H16	168.8°	60.0°
C01	P01	O03	O1	121.8°	120.0°
C01	P01	O03	C07	174.0°	175.0°
P01	C01	H7	H8	120.8°	120.0°
C01	P01	O01	H9	118.9°	60.0°
P01	C01	C02	H10	5.7°	60.0°
P01	C01	C02	H11	113.1°	60.0°
C04	C03	C02	H10	23.2°	60.0°
C04	C03	C02	H11	95.6°	60.0°
C04	C03	H13	H14	118.9°	120.0°
C03	C04	H15	H16	119.6°	120.0°
C03	C04	C05	H17	73.6°	60.1°
C03	C04	C05	H18	46.3°	60.0°
O02	C14	C15	C13	179.1°	180.0°
O02	C14	C15	C16	179.3°	180.0°
O02	C14	C13	C08	1.7°	0.0°
O02	C14	C13	N02	179.4°	179.7°
O02	C14	C15	H4	0.7°	0.0°
P01	O03	C07	C12	25.9°	75.0°
P01	O03	C07	C08	155.4°	105.0°
O03	P01	C01	H7	62.2°	55.0°
O03	P01	C01	H8	177.2°	65.0°
O03	P01	O01	H9	126.5°	60.0°
C14	C15	C16	H4	180.0°	180.0°
C15	C14	C13	C08	179.2°	180.0°
C15	C14	C13	N02	0.3°	0.3°
C14	C15	C16	C17	0.3°	0.0°
C14	C15	C16	H5	179.7°	180.0°
C15	C14	O02	H12	180.0°	90.0°
C13	C14	C15	C16	0.2°	0.0°
C14	C13	C08	C07	40.3°	179.7°
C14	C13	C08	N02	178.9°	179.7°
C14	C13	C08	N01	140.4°	0.1°
C14	C13	N02	C17	0.1°	0.6°
C13	C14	C15	H4	179.8°	180.0°
C13	C14	O02	H12	0.9°	89.9°
O03	C07	C12	C08	178.7°	180.0°
O03	C07	C12	C11	179.1°	180.0°
O03	C07	C08	C13	0.0°	0.0°
O03	C07	C08	N01	179.3°	179.8°
O03	C07	C12	H3	0.9°	0.0°
C07	O03	P01	O1	52.2°	55.0°
C15	C16	C17	H5	180.0°	180.0°
C15	C16	C17	N02	0.6°	0.3°
C15	C16	C17	H6	179.4°	180.0°
C07	C12	C11	H3	180.0°	180.0°
C12	C07	C08	C13	178.7°	180.0°
C12	C07	C08	N01	0.7°	0.2°
C07	C12	C11	C10	0.8°	0.0°
C07	C12	C11	H2	179.2°	180.0°
C08	C07	C12	C11	0.4°	0.0°
C07	C08	C13	N01	179.4°	179.8°
C07	C08	C13	N02	140.9°	0.1°
C07	C08	N01	C10	0.2°	0.5°
C08	C07	C12	H3	179.6°	180.0°
C12	C11	C10	H2	180.0°	180.0°
C12	C11	C10	N01	1.7°	0.2°
C12	C11	C10	H1	178.3°	180.0°
C13	C08	N01	C10	179.7°	179.7°
C08	C13	N02	C17	178.9°	179.7°
C13	N02	C17	C16	0.6°	0.6°
N02	C13	C08	N01	38.5°	179.8°
C13	N02	C17	H6	179.4°	179.7°
C16	C17	N02	H6	180.0°	179.7°
C17	C16	C15	H4	179.7°	180.0°
C08	N01	C10	C11	1.4°	0.5°
C08	N01	C10	H1	178.6°	179.8°
C11	C10	N01	H1	180.0°	179.7°
C10	C11	C12	H3	179.2°	180.0°
N01	C10	C11	H2	178.3°	179.8°
N02	C17	C16	H5	179.3°	179.7°
H1	C10	C11	H2	1.7°	0.0°
H2	C11	C12	H3	0.8°	0.0°
H4	C15	C16	H5	0.3°	0.0°
H5	C16	C17	H6	0.6°	0.0°
H7	C01	C02	H10	114.0°	180.0°
H7	C01	C02	H11	127.1°	60.0°
H7	C01	P01	O1	64.8°	65.0°
H8	C01	C02	H10	125.4°	60.0°
H8	C01	C02	H11	6.6°	180.0°
H8	C01	P01	O1	55.8°	175.0°
H9	O01	P01	O1	0.0°	180.0°
H10	C02	C03	H13	143.6°	180.0°
H10	C02	C03	H14	97.2°	60.1°
H11	C02	C03	H13	24.8°	60.1°
H11	C02	C03	H14	144.0°	180.0°
H13	C03	C04	H15	169.4°	180.0°
H13	C03	C04	H16	70.8°	60.0°
H14	C03	C04	H15	71.4°	60.0°
H14	C03	C04	H16	48.4°	180.0°
H15	C04	C05	H17	166.3°	179.9°
H15	C04	C05	H18	73.8°	60.0°
H16	C04	C05	H17	46.4°	59.9°
H16	C04	C05	H18	166.4°	180.0°
H17	C05	C06	H19	59.9°	60.0°
H17	C05	C06	H20	60.0°	180.0°
H17	C05	C06	H21	179.9°	60.0°
H18	C05	C06	H19	60.0°	60.0°
H18	C05	C06	H20	180.0°	60.0°
H18	C05	C06	H21	60.0°	180.0°
H19	C06	H20	H21	119.9°	120.0°

Release date:	2023-07-05
Definition date:	2023-06-27
Last modified:	2023-06-30
Release status:	REL
Processing site:	PDBE
Derived from:	8PC7