7I8

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O34	P4	doub	1.48Å	1.52Å
O56	P6	doub	1.48Å	1.52Å
O14	P4	sing	1.61Å	1.51Å
O46	P6	sing	1.61Å	1.52Å
P4	O24	sing	1.61Å	1.52Å
P4	O4	sing	1.61Å	1.63Å
O5	C5	sing	1.43Å	1.42Å
P6	O66	sing	1.61Å	1.51Å
P6	O36	sing	1.61Å	1.62Å
O4	C4	sing	1.43Å	1.44Å
C5	C4	sing	1.53Å	1.52Å
C5	C6	sing	1.53Å	1.53Å
C06	O36	sing	1.43Å	1.44Å
C06	C6	sing	1.53Å	1.51Å
C4	C3	sing	1.53Å	1.52Å
C6	C1	sing	1.53Å	1.52Å
C3	O3	sing	1.43Å	1.42Å
C3	C2	sing	1.53Å	1.52Å
C1	C2	sing	1.53Å	1.52Å
C1	O1	sing	1.43Å	1.44Å
C2	O2	sing	1.43Å	1.44Å
O1	P1	sing	1.61Å	1.62Å
O31	P1	doub	1.48Å	1.52Å
O11	P1	sing	1.61Å	1.51Å
P1	O21	sing	1.61Å	1.52Å
O2	P2	sing	1.61Å	1.63Å
O32	P2	doub	1.48Å	1.52Å
O22	P2	sing	1.61Å	1.52Å
P2	O12	sing	1.61Å	1.51Å
C1	H1	sing	1.09Å	1.10Å
C2	H2	sing	1.09Å	1.10Å
C3	H3	sing	1.09Å	1.10Å
C4	H4	sing	1.09Å	1.10Å
C5	H5	sing	1.09Å	1.10Å
O46	H6	sing	0.97Å	0.95Å
O66	H7	sing	0.97Å	0.95Å
O12	H8	sing	0.97Å	0.95Å
O22	H9	sing	0.97Å	0.95Å
C06	H10	sing	1.09Å	1.10Å
C06	H11	sing	1.09Å	1.10Å
C6	H12	sing	1.09Å	1.10Å
O3	H13	sing	0.97Å	0.95Å
O5	H14	sing	0.97Å	0.95Å
O11	H15	sing	0.97Å	0.95Å
O21	H16	sing	0.97Å	0.95Å
O14	H17	sing	0.97Å	0.95Å
O24	H18	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O34	P4	O14	112.9°	109.4°
O34	P4	O24	112.6°	109.5°
O34	P4	O4	104.9°	109.5°
O56	P6	O46	112.6°	109.4°
O56	P6	O66	112.8°	109.5°
O56	P6	O36	106.4°	109.5°
O14	P4	O24	113.0°	109.5°
O14	P4	O4	106.1°	109.5°
P4	O14	H17	109.5°	113.9°
O46	P6	O66	113.2°	109.5°
O46	P6	O36	105.7°	109.4°
P6	O46	H6	109.5°	114.0°
O24	P4	O4	106.5°	109.5°
P4	O24	H18	109.5°	114.0°
P4	O4	C4	144.4°	123.0°
O5	C5	C4	110.8°	109.5°
O5	C5	C6	110.5°	109.5°
O5	C5	H5	109.4°	109.5°
C5	O5	H14	109.5°	114.0°
O66	P6	O36	105.4°	109.5°
P6	O66	H7	109.5°	114.0°
P6	O36	C06	118.8°	123.0°
O4	C4	C5	108.7°	109.5°
O4	C4	C3	109.7°	109.4°
O4	C4	H4	109.8°	109.5°
C4	C5	C6	109.9°	109.5°
C5	C4	C3	111.2°	109.5°
C5	C4	H4	108.7°	109.5°
C4	C5	H5	108.1°	109.5°
C5	C6	C06	112.9°	109.5°
C5	C6	C1	105.4°	109.5°
C6	C5	H5	108.0°	109.4°
C5	C6	H12	108.5°	109.4°
O36	C06	C6	111.5°	109.5°
O36	C06	H10	109.0°	109.5°
O36	C06	H11	109.0°	109.5°
C06	C6	C1	112.6°	109.5°
C6	C06	H10	109.0°	109.5°
C6	C06	H11	109.0°	109.4°
C06	C6	H12	108.7°	109.5°
C4	C3	O3	110.4°	109.5°
C4	C3	C2	107.8°	109.4°
C4	C3	H3	109.2°	109.5°
C3	C4	H4	108.7°	109.5°
C6	C1	C2	109.7°	109.5°
C6	C1	O1	107.9°	109.5°
C6	C1	H1	109.5°	109.5°
C1	C6	H12	108.6°	109.5°
O3	C3	C2	109.6°	109.5°
O3	C3	H3	110.6°	109.5°
C3	O3	H13	109.5°	114.0°
C3	C2	C1	111.3°	109.5°
C3	C2	O2	109.4°	109.5°
C3	C2	H2	108.5°	109.5°
C2	C3	H3	109.2°	109.5°
C2	C1	O1	109.6°	109.5°
C1	C2	O2	109.6°	109.5°
C2	C1	H1	109.5°	109.5°
C1	C2	H2	108.5°	109.5°
C1	O1	P1	133.2°	123.0°
O1	C1	H1	110.6°	109.5°
C2	O2	P2	130.2°	123.0°
O2	C2	H2	109.6°	109.5°
O1	P1	O31	106.8°	109.5°
O1	P1	O11	105.5°	109.4°
O1	P1	O21	104.9°	109.4°
O31	P1	O11	113.1°	109.5°
O31	P1	O21	112.7°	109.5°
O11	P1	O21	113.1°	109.5°
P1	O11	H15	109.5°	114.0°
P1	O21	H16	109.5°	113.9°
O2	P2	O32	105.1°	109.5°
O2	P2	O22	106.0°	109.4°
O2	P2	O12	106.0°	109.4°
O32	P2	O22	112.7°	109.5°
O32	P2	O12	113.1°	109.5°
O22	P2	O12	113.1°	109.5°
P2	O22	H9	109.5°	114.0°
P2	O12	H8	109.5°	114.0°
H10	C06	H11	109.5°	109.4°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O34	P4	O14	O24	129.3°	120.0°
O34	P4	O14	O4	114.4°	120.0°
O34	P4	O24	O4	114.5°	120.0°
O34	P4	O4	C4	8.9°	55.0°
O34	P4	O14	H17	0.0°	180.0°
O34	P4	O24	H18	0.0°	60.0°
O56	P6	O46	O66	129.4°	120.0°
O56	P6	O46	O36	115.7°	120.0°
O56	P6	O66	O36	115.7°	120.1°
O56	P6	O36	C06	109.5°	55.1°
O56	P6	O46	H6	0.0°	60.0°
O56	P6	O66	H7	0.0°	180.0°
O14	P4	O24	O4	116.1°	120.0°
O14	P4	O4	C4	110.8°	65.0°
O14	P4	O24	H18	129.4°	60.0°
O46	P6	O66	O36	115.0°	120.0°
O46	P6	O36	C06	10.4°	175.0°
O46	P6	O66	H7	129.3°	60.0°
O24	P4	O4	C4	128.5°	175.0°
O24	P4	O14	H17	129.3°	60.0°
P4	O4	C4	C5	71.2°	120.0°
P4	O4	C4	C3	167.0°	120.0°
P4	O4	C4	H4	47.6°	0.0°
O4	P4	O14	H17	114.4°	60.0°
O4	P4	O24	H18	114.5°	180.0°
O5	C5	C4	O4	55.2°	60.0°
O5	C5	C4	C6	122.4°	120.0°
O5	C5	C4	H5	119.9°	120.0°
O5	C5	C6	H5	119.7°	120.0°
O5	C5	C6	C06	51.2°	60.0°
O5	C5	C4	C3	176.1°	180.0°
O5	C5	C6	C1	174.5°	180.0°
O5	C5	C4	H4	64.3°	60.0°
O5	C5	C6	H12	69.4°	60.0°
O66	P6	O36	C06	130.6°	65.0°
O66	P6	O46	H6	129.4°	59.9°
P6	O36	C06	C6	77.2°	180.0°
O36	P6	O46	H6	115.7°	180.0°
O36	P6	O66	H7	115.6°	60.0°
P6	O36	C06	H10	43.1°	60.0°
P6	O36	C06	H11	162.5°	60.0°
O4	C4	C5	C3	120.9°	120.0°
O4	C4	C5	H4	119.5°	120.0°
O4	C4	C5	C6	177.6°	180.0°
O4	C4	C3	H4	120.1°	120.0°
O4	C4	C3	O3	64.0°	60.0°
O4	C4	C3	C2	176.3°	180.0°
O4	C4	C3	H3	57.7°	60.0°
O4	C4	C5	H5	64.7°	60.0°
C4	C5	C6	H5	117.7°	120.0°
C4	C5	C6	C06	173.7°	180.0°
C5	C4	C3	H4	119.6°	120.0°
C4	C5	C6	C1	62.9°	60.0°
C5	C4	C3	O3	175.7°	180.0°
C5	C4	C3	C2	56.0°	60.0°
C5	C4	C3	H3	62.6°	60.0°
C4	C5	C6	H12	53.2°	60.0°
C4	C5	O5	H14	11.7°	60.0°
C5	C6	C06	O36	153.5°	65.0°
C5	C6	C06	C1	119.2°	120.0°
C5	C6	C06	H12	120.4°	119.9°
C6	C5	C4	C3	61.5°	60.0°
C5	C6	C1	H12	116.1°	119.9°
C5	C6	C1	C2	63.3°	60.0°
C5	C6	C1	O1	177.4°	180.0°
C5	C6	C1	H1	57.0°	60.1°
C6	C5	C4	H4	58.1°	60.0°
C5	C6	C06	H10	33.2°	55.1°
C5	C6	C06	H11	86.2°	175.0°
C6	C5	O5	H14	133.8°	180.0°
O36	C06	C6	H10	120.3°	120.1°
O36	C06	C6	H11	120.3°	120.0°
O36	C06	C6	C1	87.3°	175.0°
O36	C06	H10	H11	119.1°	120.0°
O36	C06	C6	H12	33.1°	54.9°
C06	C6	C1	H12	120.5°	120.0°
C06	C6	C1	C2	173.3°	180.0°
C06	C6	C1	O1	53.9°	60.0°
C06	C6	C1	H1	66.5°	60.0°
C06	C6	C5	H5	68.5°	60.0°
C6	C06	H10	H11	119.1°	119.9°
C4	C3	O3	C2	118.6°	119.9°
C4	C3	O3	H3	120.9°	120.1°
C4	C3	C2	H3	118.5°	120.0°
C4	C3	C2	C1	56.6°	60.0°
C4	C3	C2	O2	177.8°	180.0°
C4	C3	C2	H2	62.8°	60.0°
C3	C4	C5	H5	56.2°	60.0°
C4	C3	O3	H13	144.5°	60.0°
C6	C1	C2	C3	62.6°	60.0°
C6	C1	C2	O1	118.3°	120.0°
C6	C1	C2	H1	120.2°	120.0°
C6	C1	O1	H1	119.8°	120.0°
C6	C1	C2	O2	176.3°	180.0°
C6	C1	O1	P1	127.9°	120.0°
C6	C1	C2	H2	56.7°	60.0°
C1	C6	C5	H5	54.8°	60.0°
C1	C6	C06	H10	152.4°	65.0°
C1	C6	C06	H11	33.0°	55.0°
O3	C3	C2	H3	121.3°	120.0°
O3	C3	C2	C1	176.7°	180.0°
O3	C3	C2	O2	62.1°	60.0°
O3	C3	C2	H2	57.4°	60.0°
O3	C3	C4	H4	56.0°	59.9°
C3	C2	C1	O2	121.1°	120.0°
C3	C2	C1	H2	119.3°	120.0°
C3	C2	C1	O1	179.0°	180.0°
C3	C2	O2	H2	118.8°	120.0°
C3	C2	O2	P2	96.5°	120.0°
C3	C2	C1	H1	57.6°	60.0°
C2	C3	C4	H4	63.6°	60.0°
C2	C3	O3	H13	26.0°	180.0°
C2	C1	O1	H1	120.8°	120.0°
C1	C2	O2	H2	118.9°	120.0°
C2	C1	O1	P1	112.7°	120.0°
C1	C2	O2	P2	141.2°	120.0°
C1	C2	C3	H3	62.0°	60.0°
C2	C1	C6	H12	52.8°	60.0°
O1	C1	C2	O2	58.0°	60.0°
C1	O1	P1	O31	150.8°	55.0°
C1	O1	P1	O11	30.3°	65.0°
C1	O1	P1	O21	89.4°	175.0°
O1	C1	C2	H2	61.6°	60.0°
O1	C1	C6	H12	66.5°	60.0°
C2	O2	P2	O32	58.5°	55.0°
C2	O2	P2	O22	61.0°	175.0°
C2	O2	P2	O12	178.5°	65.0°
O2	C2	C1	H1	63.5°	60.0°
O2	C2	C3	H3	59.2°	60.0°
O1	P1	O31	O11	115.6°	120.0°
O1	P1	O31	O21	114.7°	120.0°
O1	P1	O11	O21	114.1°	120.0°
P1	O1	C1	H1	8.1°	0.0°
O1	P1	O11	H15	116.3°	60.0°
O1	P1	O21	H16	115.8°	180.0°
O31	P1	O11	O21	129.6°	120.0°
O31	P1	O11	H15	0.0°	180.0°
O31	P1	O21	H16	0.0°	60.0°
O11	P1	O21	H16	129.8°	60.0°
O21	P1	O11	H15	129.6°	59.9°
O2	P2	O32	O22	115.0°	120.0°
O2	P2	O32	O12	115.2°	120.0°
O2	P2	O22	O12	115.8°	119.9°
P2	O2	C2	H2	22.3°	0.0°
O2	P2	O12	H8	114.7°	60.0°
O2	P2	O22	H9	114.4°	180.0°
O32	P2	O22	O12	129.8°	120.0°
O32	P2	O12	H8	0.0°	180.0°
O32	P2	O22	H9	0.0°	60.0°
O22	P2	O12	H8	129.6°	59.9°
O12	P2	O22	H9	129.8°	60.1°
H1	C1	C2	H2	176.9°	180.0°
H1	C1	C6	H12	173.0°	180.0°
H2	C2	C3	H3	178.7°	180.0°
H3	C3	C4	H4	177.8°	180.0°
H3	C3	O3	H13	94.5°	60.0°
H4	C4	C5	H5	175.8°	180.0°
H5	C5	C6	H12	171.0°	180.0°
H5	C5	O5	H14	107.4°	60.0°
H10	C06	C6	H12	87.2°	175.0°
H11	C06	C6	H12	153.4°	65.1°

Release date:	2024-02-28
Definition date:	2023-07-12
Last modified:	2024-02-23
Release status:	REL
Processing site:	PDBE
Derived from:	8PPE