XOG

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O1	C1	doub	1.21Å	0.00Å
C1	C2	sing	1.46Å	0.00Å
C2	C9	sing	1.51Å	0.00Å
C2	C3	doub	1.33Å	0.00Å
C3	C4	sing	1.51Å	0.00Å
C4	C5	sing	1.53Å	0.00Å
C5	C6	sing	1.51Å	0.00Å
C6	C7	doub	1.33Å	0.00Å
C6	C10	sing	1.51Å	0.00Å
C7	C8	sing	1.46Å	0.00Å
C8	O2	doub	1.21Å	0.00Å
C8	H2	sing	1.08Å	0.00Å
C7	H4	sing	1.08Å	0.00Å
C10	H5	sing	1.09Å	0.00Å
C10	H6	sing	1.09Å	0.00Å
C10	H7	sing	1.09Å	0.00Å
C5	H8	sing	1.09Å	0.00Å
C5	H9	sing	1.09Å	0.00Å
C4	H10	sing	1.09Å	0.00Å
C4	H11	sing	1.09Å	0.00Å
C3	H12	sing	1.08Å	0.00Å
C9	H13	sing	1.09Å	0.00Å
C9	H14	sing	1.09Å	0.00Å
C9	H15	sing	1.09Å	0.00Å
C1	H16	sing	1.08Å	0.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O1	C1	C2	90.0°	120.0°
O1	C1	H16	90.0°	120.1°
C1	C2	C9	90.0°	120.0°
C1	C2	C3	90.0°	120.0°
C2	C1	H16	90.0°	120.0°
C9	C2	C3	90.0°	120.0°
C2	C9	H13	90.0°	109.5°
C2	C9	H14	90.0°	109.5°
C2	C9	H15	90.0°	109.5°
C2	C3	C4	90.0°	120.0°
C2	C3	H12	90.0°	120.0°
C3	C4	C5	90.0°	109.5°
C3	C4	H10	90.0°	109.5°
C3	C4	H11	90.0°	109.4°
C4	C3	H12	90.0°	120.0°
C4	C5	C6	90.0°	109.5°
C4	C5	H8	90.0°	109.5°
C4	C5	H9	90.0°	109.4°
C5	C4	H10	90.0°	109.5°
C5	C4	H11	90.0°	109.5°
C5	C6	C7	90.0°	120.0°
C5	C6	C10	90.0°	120.0°
C6	C5	H8	90.0°	109.5°
C6	C5	H9	90.0°	109.5°
C7	C6	C10	90.0°	120.0°
C6	C7	C8	90.0°	120.0°
C6	C7	H4	90.0°	120.0°
C6	C10	H5	90.0°	109.5°
C6	C10	H6	90.0°	109.4°
C6	C10	H7	90.0°	109.5°
C7	C8	O2	90.0°	120.0°
C7	C8	H2	90.0°	120.0°
C8	C7	H4	90.0°	120.0°
O2	C8	H2	90.0°	120.0°
H5	C10	H6	90.0°	109.5°
H5	C10	H7	90.0°	109.5°
H6	C10	H7	90.0°	109.5°
H8	C5	H9	90.0°	109.4°
H10	C4	H11	90.0°	109.4°
H13	C9	H14	90.0°	109.5°
H13	C9	H15	90.0°	109.4°
H14	C9	H15	90.0°	109.4°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O1	C1	C2	H16	90.0°	179.9°
O1	C1	C2	C9	90.0°	0.0°
O1	C1	C2	C3	90.0°	180.0°
C1	C2	C9	C3	90.0°	180.0°
C1	C2	C3	C4	90.0°	173.9°
C1	C2	C3	H12	90.0°	6.1°
C1	C2	C9	H13	90.0°	95.0°
C1	C2	C9	H14	90.0°	25.1°
C1	C2	C9	H15	90.0°	145.1°
C9	C2	C3	C4	90.0°	6.1°
C9	C2	C3	H12	90.0°	173.9°
C2	C9	H13	H14	90.0°	120.1°
C2	C9	H13	H15	90.0°	120.0°
C2	C9	H14	H15	90.0°	120.0°
C9	C2	C1	H16	90.0°	180.0°
C2	C3	C4	H12	90.0°	180.0°
C2	C3	C4	C5	90.0°	126.1°
C2	C3	C4	H10	90.0°	113.8°
C2	C3	C4	H11	90.0°	6.1°
C3	C2	C9	H13	90.0°	85.1°
C3	C2	C9	H14	90.0°	154.8°
C3	C2	C9	H15	90.0°	34.9°
C3	C2	C1	H16	90.0°	0.1°
C3	C4	C5	H10	90.0°	120.0°
C3	C4	C5	H11	90.0°	120.0°
C3	C4	C5	C6	90.0°	NaN°
C3	C4	C5	H8	90.0°	60.0°
C3	C4	C5	H9	90.0°	60.0°
C3	C4	H10	H11	90.0°	120.0°
C4	C5	C6	H8	90.0°	120.0°
C4	C5	C6	H9	90.0°	120.0°
C4	C5	C6	C7	90.0°	95.0°
C4	C5	C6	C10	90.0°	85.0°
C4	C5	H8	H9	90.0°	119.9°
C5	C4	H10	H11	90.0°	120.0°
C5	C4	C3	H12	90.0°	53.8°
C5	C6	C7	C10	90.0°	180.0°
C5	C6	C7	C8	90.0°	180.0°
C5	C6	C7	H4	90.0°	0.0°
C5	C6	C10	H5	90.0°	89.9°
C5	C6	C10	H6	90.0°	30.0°
C5	C6	C10	H7	90.0°	150.0°
C6	C5	H8	H9	90.0°	120.0°
C6	C5	C4	H10	90.0°	60.0°
C6	C5	C4	H11	90.0°	60.0°
C6	C7	C8	H4	90.0°	180.0°
C6	C7	C8	O2	90.0°	180.0°
C6	C7	C8	H2	90.0°	0.2°
C7	C6	C10	H5	90.0°	90.0°
C7	C6	C10	H6	90.0°	150.0°
C7	C6	C10	H7	90.0°	30.1°
C7	C6	C5	H8	90.0°	145.0°
C7	C6	C5	H9	90.0°	25.0°
C10	C6	C7	C8	90.0°	0.1°
C10	C6	C7	H4	90.0°	180.0°
C6	C10	H5	H6	90.0°	119.9°
C6	C10	H5	H7	90.0°	120.0°
C6	C10	H6	H7	90.0°	120.0°
C10	C6	C5	H8	90.0°	35.0°
C10	C6	C5	H9	90.0°	155.0°
C7	C8	O2	H2	90.0°	179.7°
O2	C8	C7	H4	90.0°	0.0°
H2	C8	C7	H4	90.0°	179.7°
H5	C10	H6	H7	90.0°	120.1°
H8	C5	C4	H10	90.0°	180.0°
H8	C5	C4	H11	90.0°	60.0°
H9	C5	C4	H10	90.0°	60.1°
H9	C5	C4	H11	90.0°	180.0°
H10	C4	C3	H12	90.0°	66.2°
H11	C4	C3	H12	90.0°	173.8°
H13	C9	H14	H15	90.0°	119.9°

Release date:	2015-11-04
Definition date:	2015-07-27
Last modified:	2021-03-01
Release status:	REL
Processing site:	RCSB