7OY

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
F26	C13	sing	1.40Å	1.36Å
C14	C13	sing	1.53Å	1.51Å
C14	N15	sing	1.47Å	1.44Å
O19	C17	doub	1.22Å	1.22Å
C13	F25	sing	1.40Å	1.37Å
C13	C12	sing	1.53Å	1.52Å
C17	N15	sing	1.35Å	1.37Å
C17	C18	sing	1.48Å	1.46Å
N15	C16	sing	1.47Å	1.45Å
C12	C11	sing	1.53Å	1.51Å
C23	C18	doub	1.40Å	1.38Å	Aromatic
C23	C22	sing	1.38Å	1.37Å	Aromatic
C16	C11	sing	1.53Å	1.52Å
C18	C20	sing	1.40Å	1.38Å	Aromatic
C11	C6	sing	1.51Å	1.50Å
C22	C27	doub	1.39Å	1.37Å	Aromatic
C20	C21	doub	1.38Å	1.38Å	Aromatic
C1	C6	doub	1.36Å	1.34Å	Aromatic
C1	C2	sing	1.40Å	1.47Å	Aromatic
C6	N5	sing	1.36Å	1.37Å	Aromatic
C27	C21	sing	1.39Å	1.37Å	Aromatic
C27	F28	sing	1.35Å	1.34Å
C21	CL24	sing	1.74Å	1.73Å
C10	C2	sing	1.51Å	1.50Å
C2	N3	doub	1.31Å	1.30Å	Aromatic
N5	N9	sing	1.40Å	1.34Å	Aromatic
N5	C4	sing	1.37Å	1.37Å	Aromatic
N9	C8	doub	1.31Å	1.33Å	Aromatic
N3	C4	sing	1.34Å	1.34Å	Aromatic
C4	N7	doub	1.33Å	1.31Å	Aromatic
C8	N7	sing	1.33Å	1.36Å	Aromatic
C8	H1	sing	1.08Å	1.08Å
C10	H2	sing	1.09Å	1.10Å
C10	H3	sing	1.09Å	1.10Å
C10	H4	sing	1.09Å	1.10Å
C20	H5	sing	1.08Å	1.08Å
C22	H6	sing	1.08Å	1.08Å
C23	H7	sing	1.08Å	1.08Å
C1	H8	sing	1.08Å	1.08Å
C12	H9	sing	1.09Å	1.10Å
C12	H10	sing	1.09Å	1.10Å
C16	H11	sing	1.09Å	1.10Å
C16	H12	sing	1.09Å	1.10Å
C14	H13	sing	1.09Å	1.10Å
C14	H14	sing	1.09Å	1.10Å
C11	H15	sing	1.09Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
F26	C13	C14	107.7°	109.6°
F26	C13	F25	106.7°	109.5°
F26	C13	C12	111.3°	109.5°
C13	C14	N15	112.5°	108.8°
C14	C13	F25	110.4°	109.5°
C14	C13	C12	111.4°	109.3°
C13	C14	H13	108.7°	109.6°
C13	C14	H14	108.7°	109.6°
C14	N15	C17	116.1°	120.6°
C14	N15	C16	119.4°	118.7°
N15	C14	H13	108.7°	109.6°
N15	C14	H14	108.7°	109.6°
O19	C17	N15	124.6°	120.0°
O19	C17	C18	116.8°	120.0°
F25	C13	C12	109.3°	109.5°
C13	C12	C11	111.7°	109.5°
C13	C12	H9	108.9°	109.5°
C13	C12	H10	108.9°	109.5°
N15	C17	C18	118.6°	120.0°
C17	N15	C16	124.5°	120.7°
C17	C18	C23	115.0°	120.1°
C17	C18	C20	121.9°	120.1°
N15	C16	C11	112.5°	108.8°
N15	C16	H11	108.7°	109.6°
N15	C16	H12	108.7°	109.7°
C12	C11	C16	115.4°	109.3°
C12	C11	C6	115.0°	109.5°
C11	C12	H9	108.9°	109.4°
C11	C12	H10	108.9°	109.5°
C12	C11	H15	101.9°	109.4°
C18	C23	C22	118.6°	119.9°
C23	C18	C20	123.1°	119.8°
C18	C23	H7	120.7°	120.1°
C23	C22	C27	119.1°	120.1°
C23	C22	H6	120.5°	119.9°
C22	C23	H7	120.7°	120.1°
C16	C11	C6	117.2°	109.5°
C11	C16	H11	108.7°	109.6°
C11	C16	H12	108.7°	109.5°
C16	C11	H15	101.8°	109.5°
C18	C20	C21	117.1°	119.8°
C18	C20	H5	121.5°	120.1°
C11	C6	C1	125.0°	120.5°
C11	C6	N5	117.0°	120.5°
C6	C11	H15	102.0°	109.5°
C22	C27	C21	121.9°	120.2°
C22	C27	F28	119.7°	119.8°
C27	C22	H6	120.4°	120.0°
C20	C21	C27	120.2°	120.1°
C20	C21	CL24	123.2°	119.9°
C21	C20	H5	121.5°	120.1°
C6	C1	C2	116.4°	119.2°
C1	C6	N5	118.0°	119.0°
C6	C1	H8	121.8°	120.4°
C1	C2	C10	117.2°	119.8°
C1	C2	N3	124.6°	120.4°
C2	C1	H8	121.8°	120.4°
C6	N5	N9	127.8°	133.4°
C6	N5	C4	122.7°	120.3°
C21	C27	F28	118.4°	119.9°
C27	C21	CL24	116.6°	120.0°
C10	C2	N3	118.2°	119.8°
C2	C10	H2	109.5°	109.4°
C2	C10	H3	109.4°	109.5°
C2	C10	H4	109.5°	109.5°
C2	N3	C4	116.7°	120.8°
N9	N5	C4	109.5°	106.4°
N5	N9	C8	103.1°	107.0°
N5	C4	N3	121.7°	120.3°
N5	C4	N7	109.8°	107.2°
N9	C8	N7	114.1°	109.6°
N9	C8	H1	123.0°	125.2°
N3	C4	N7	128.5°	132.5°
C4	N7	C8	103.5°	109.8°
N7	C8	H1	123.0°	125.2°
H2	C10	H3	109.5°	109.4°
H2	C10	H4	109.5°	109.5°
H3	C10	H4	109.4°	109.5°
H9	C12	H10	109.4°	109.5°
H11	C16	H12	109.4°	109.6°
H13	C14	H14	109.5°	109.7°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
F26	C13	C14	F25	116.1°	120.1°
F26	C13	C14	C12	122.2°	119.9°
F26	C13	C14	N15	174.4°	174.6°
F26	C13	F25	C12	120.4°	120.0°
F26	C13	C12	C11	172.7°	178.7°
F26	C13	C12	H9	52.4°	61.4°
F26	C13	C12	H10	66.9°	58.6°
F26	C13	C14	H13	65.2°	65.6°
F26	C13	C14	H14	54.0°	54.8°
C13	C14	N15	H13	120.4°	119.8°
C13	C14	N15	H14	120.4°	119.8°
C14	C13	F25	C12	122.9°	119.8°
C13	C14	N15	C17	130.1°	126.4°
C13	C14	N15	C16	48.0°	53.6°
C14	C13	C12	C11	52.6°	61.3°
C14	C13	C12	H9	67.8°	58.6°
C14	C13	C12	H10	172.9°	178.6°
C13	C14	H13	H14	118.6°	120.3°
C14	N15	C17	O19	9.9°	176.2°
N15	C14	C13	F25	69.5°	65.3°
N15	C14	C13	C12	52.1°	54.6°
C14	N15	C17	C16	178.0°	180.0°
C14	N15	C17	C18	169.9°	3.8°
C14	N15	C16	C11	41.2°	53.6°
C14	N15	C16	H11	161.6°	66.2°
C14	N15	C16	H12	79.3°	173.5°
N15	C14	H13	H14	118.6°	120.4°
O19	C17	N15	C18	179.8°	180.0°
O19	C17	N15	C16	172.1°	3.7°
O19	C17	C18	C23	54.6°	129.3°
O19	C17	C18	C20	124.5°	50.8°
F25	C13	C12	C11	69.7°	58.6°
F25	C13	C12	H9	169.9°	178.6°
F25	C13	C12	H10	50.6°	61.4°
F25	C13	C14	H13	50.9°	54.5°
F25	C13	C14	H14	170.1°	174.9°
C13	C12	C11	H9	120.4°	120.0°
C13	C12	C11	H10	120.3°	120.0°
C13	C12	C11	C16	47.5°	61.3°
C13	C12	C11	C6	171.4°	178.7°
C13	C12	H9	H10	119.0°	120.0°
C12	C13	C14	H13	172.6°	174.4°
C12	C13	C14	H14	68.3°	65.2°
C13	C12	C11	H15	61.9°	58.6°
N15	C17	C18	C23	125.6°	50.8°
C17	N15	C16	C11	136.8°	126.4°
N15	C17	C18	C20	55.3°	129.2°
C17	N15	C16	H11	16.3°	113.8°
C17	N15	C16	H12	102.8°	6.6°
C17	N15	C14	H13	9.7°	6.6°
C17	N15	C14	H14	109.5°	113.8°
C18	C17	N15	C16	8.1°	176.2°
C17	C18	C23	C20	179.1°	180.0°
C17	C18	C23	C22	179.8°	179.4°
C17	C18	C20	C21	179.3°	180.0°
C17	C18	C20	H5	0.7°	0.3°
C17	C18	C23	H7	0.2°	0.1°
N15	C16	C11	C12	40.3°	54.6°
N15	C16	C11	H11	120.5°	119.8°
N15	C16	C11	H12	120.5°	119.9°
N15	C16	C11	C6	179.4°	174.6°
N15	C16	H11	H12	118.6°	120.4°
C16	N15	C14	H13	168.4°	173.4°
C16	N15	C14	H14	72.4°	66.2°
N15	C16	C11	H15	69.2°	65.2°
C12	C11	C16	C6	140.3°	120.0°
C12	C11	C16	H15	109.4°	119.9°
C12	C11	C6	H15	109.4°	120.0°
C12	C11	C6	C1	29.0°	120.0°
C12	C11	C6	N5	149.9°	60.0°
C11	C12	H9	H10	119.0°	120.0°
C12	C11	C16	H11	160.7°	65.2°
C12	C11	C16	H12	80.2°	174.6°
C18	C23	C22	H7	180.0°	179.3°
C18	C23	C22	C27	0.7°	0.9°
C23	C18	C20	C21	0.3°	0.0°
C23	C18	C20	H5	179.7°	179.7°
C18	C23	C22	H6	179.3°	179.7°
C22	C23	C18	C20	0.8°	0.6°
C23	C22	C27	H6	180.0°	179.4°
C23	C22	C27	C21	0.3°	0.5°
C23	C22	C27	F28	179.7°	179.9°
C16	C11	C6	H15	110.1°	120.1°
C16	C11	C6	C1	111.4°	120.2°
C16	C11	C6	N5	69.6°	59.8°
C16	C11	C12	H9	72.9°	58.7°
C16	C11	C12	H10	167.8°	178.6°
C11	C16	H11	H12	118.6°	120.2°
C18	C20	C21	H5	180.0°	179.7°
C18	C20	C21	C27	0.1°	0.3°
C18	C20	C21	CL24	180.0°	179.7°
C20	C18	C23	H7	179.3°	179.9°
C11	C6	C1	N5	178.9°	180.0°
C11	C6	C1	C2	179.3°	179.9°
C11	C6	N5	N9	0.3°	0.0°
C11	C6	N5	C4	179.1°	179.9°
C11	C6	C1	H8	0.7°	0.1°
C6	C11	C12	H9	68.3°	61.3°
C6	C11	C12	H10	51.0°	58.6°
C6	C11	C16	H11	59.0°	54.8°
C6	C11	C16	H12	60.1°	65.5°
C22	C27	C21	C20	0.1°	0.1°
C22	C27	C21	F28	179.9°	179.5°
C22	C27	C21	CL24	180.0°	180.0°
C27	C22	C23	H7	179.3°	179.8°
C20	C21	C27	CL24	179.9°	180.0°
C20	C21	C27	F28	179.9°	179.4°
C6	C1	C2	H8	180.0°	180.0°
C6	C1	C2	C10	179.6°	180.0°
C6	C1	C2	N3	0.5°	0.0°
C1	C6	N5	N9	179.3°	179.9°
C1	C6	N5	C4	0.1°	0.1°
C1	C6	C11	H15	138.4°	0.0°
C2	C1	C6	N5	0.4°	0.0°
C1	C2	C10	N3	179.9°	180.0°
C1	C2	N3	C4	0.3°	0.0°
C1	C2	C10	H2	179.9°	90.0°
C1	C2	C10	H3	60.1°	150.0°
C1	C2	C10	H4	59.9°	30.0°
C6	N5	N9	C4	179.5°	179.9°
C6	N5	N9	C8	179.9°	180.0°
C6	N5	C4	N3	0.2°	0.1°
C6	N5	C4	N7	179.9°	180.0°
N5	C6	C1	H8	179.6°	180.0°
N5	C6	C11	H15	40.5°	180.0°
C27	C21	C20	H5	179.9°	180.0°
C21	C27	C22	H6	179.7°	179.9°
F28	C27	C21	CL24	0.1°	0.5°
F28	C27	C22	H6	0.3°	0.5°
CL24	C21	C20	H5	0.0°	0.0°
C10	C2	N3	C4	179.8°	180.0°
C2	C10	H2	H3	120.0°	120.0°
C2	C10	H2	H4	120.0°	120.0°
C2	C10	H3	H4	120.0°	120.0°
C10	C2	C1	H8	0.4°	0.0°
C2	N3	C4	N5	0.1°	0.0°
C2	N3	C4	N7	180.0°	180.0°
N3	C2	C10	H2	0.0°	90.0°
N3	C2	C10	H3	120.0°	29.9°
N3	C2	C10	H4	120.0°	150.0°
N3	C2	C1	H8	179.5°	180.0°
N9	N5	C4	N3	179.7°	180.0°
N9	N5	C4	N7	0.3°	0.1°
N5	N9	C8	N7	0.6°	0.1°
N5	N9	C8	H1	179.3°	179.9°
C4	N5	N9	C8	0.6°	0.1°
N5	C4	N3	N7	179.9°	180.0°
N5	C4	N7	C8	0.1°	0.0°
N9	C8	N7	C4	0.4°	0.0°
N9	C8	N7	H1	180.0°	180.0°
N3	C4	N7	C8	179.9°	180.0°
C4	N7	C8	H1	179.5°	180.0°
H2	C10	H3	H4	120.0°	120.0°
H6	C22	C23	H7	0.7°	0.4°
H9	C12	C11	H15	177.8°	178.6°
H10	C12	C11	H15	58.5°	61.4°
H11	C16	C11	H15	51.3°	174.9°
H12	C16	C11	H15	170.4°	54.7°

Release date:	2017-02-22
Definition date:	2016-11-28
Last modified:	2017-02-17
Release status:	REL
Processing site:	RCSB
Derived from:	5TZX