A1BZC

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
F3	C2	sing	1.40Å	1.37Å
C2	F4	sing	1.40Å	1.37Å
C2	C5	sing	1.51Å	1.51Å
C2	F1	sing	1.40Å	1.36Å
C5	C13	doub	1.38Å	1.38Å	Aromatic
C5	C6	sing	1.38Å	1.38Å	Aromatic
C13	C12	sing	1.39Å	1.40Å	Aromatic
C6	C7	doub	1.39Å	1.41Å	Aromatic
C12	C14	sing	1.48Å	1.48Å
C12	C11	doub	1.41Å	1.40Å	Aromatic
O18	C14	sing	1.35Å	1.36Å	Aromatic
O18	C17	sing	1.34Å	1.33Å	Aromatic
C14	C15	doub	1.36Å	1.35Å	Aromatic
C17	N16	doub	1.30Å	1.30Å	Aromatic
C7	C11	sing	1.40Å	1.39Å	Aromatic
C7	N8	sing	1.38Å	1.41Å	Aromatic
C15	N16	sing	1.34Å	1.35Å	Aromatic
C11	C10	sing	1.46Å	1.51Å	Aromatic
O20	C19	doub	1.21Å	1.21Å
N8	C19	sing	1.35Å	1.37Å
N8	C9	sing	1.38Å	1.48Å	Aromatic
C22	C21	sing	1.53Å	1.48Å
C22	C23	sing	1.53Å	1.55Å
C19	C21	sing	1.51Å	1.46Å
C10	C9	doub	1.34Å	1.54Å	Aromatic
C21	C23	sing	1.53Å	1.48Å
C6	H1	sing	1.08Å	1.08Å
C10	H2	sing	1.08Å	1.08Å
C13	H3	sing	1.08Å	1.08Å
C15	H4	sing	1.08Å	1.08Å
C17	H5	sing	1.08Å	1.08Å
C21	H6	sing	1.09Å	1.10Å
C22	H7	sing	1.09Å	1.10Å
C22	H8	sing	1.09Å	1.10Å
C9	H9	sing	1.08Å	1.08Å
C23	H10	sing	1.09Å	1.10Å
C23	H11	sing	1.09Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
F3	C2	F4	108.0°	109.5°
F3	C2	C5	110.6°	109.5°
F3	C2	F1	105.5°	109.4°
F4	C2	C5	113.3°	109.5°
F4	C2	F1	107.0°	109.5°
C5	C2	F1	112.1°	109.5°
C2	C5	C13	119.4°	119.6°
C2	C5	C6	120.1°	119.6°
C13	C5	C6	120.5°	120.7°
C5	C13	C12	120.4°	120.2°
C5	C13	H3	119.8°	119.9°
C5	C6	C7	120.3°	120.3°
C5	C6	H1	119.9°	119.9°
C13	C12	C14	118.0°	120.3°
C13	C12	C11	118.8°	119.3°
C12	C13	H3	119.8°	119.9°
C6	C7	C11	118.9°	119.6°
C6	C7	N8	129.1°	133.3°
C7	C6	H1	119.8°	119.9°
C14	C12	C11	123.2°	120.3°
C12	C14	O18	125.0°	126.6°
C12	C14	C15	129.5°	126.6°
C12	C11	C7	121.2°	119.8°
C12	C11	C10	130.4°	133.9°
C14	O18	C17	109.1°	107.7°
O18	C14	C15	105.5°	106.8°
O18	C17	N16	108.3°	109.0°
O18	C17	H5	125.9°	125.5°
C14	C15	N16	108.0°	107.5°
C14	C15	H4	126.0°	126.3°
C17	N16	C15	109.0°	108.9°
N16	C17	H5	125.8°	125.5°
C11	C7	N8	112.0°	107.1°
C7	C11	C10	108.4°	106.3°
C7	N8	C19	125.0°	125.2°
C7	N8	C9	108.7°	109.6°
N16	C15	H4	126.0°	126.2°
C11	C10	C9	104.7°	107.2°
C11	C10	H2	127.6°	126.4°
O20	C19	N8	123.4°	120.0°
O20	C19	C21	111.3°	120.0°
C19	N8	C9	126.3°	125.2°
N8	C19	C21	125.4°	120.0°
N8	C9	C10	105.4°	109.8°
N8	C9	H9	127.3°	125.1°
C21	C22	C23	58.5°	60.0°
C22	C21	C19	141.6°	117.5°
C22	C21	C23	63.0°	60.0°
C22	C21	H6	100.9°	117.5°
C21	C22	H7	120.3°	117.5°
C21	C22	H8	120.2°	117.5°
C22	C23	C21	58.5°	60.0°
C23	C22	H7	120.3°	117.5°
C23	C22	H8	120.3°	117.5°
C22	C23	H10	120.3°	117.6°
C22	C23	H11	120.3°	117.5°
C19	C21	C23	140.7°	117.5°
C19	C21	H6	101.1°	115.5°
C9	C10	H2	127.7°	126.4°
C10	C9	H9	127.3°	125.1°
C23	C21	H6	101.0°	117.5°
C21	C23	H10	120.2°	117.5°
C21	C23	H11	120.2°	117.4°
H7	C22	H8	109.4°	115.6°
H10	C23	H11	109.5°	115.6°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
F3	C2	F4	C5	122.8°	120.0°
F3	C2	F4	F1	113.2°	120.0°
F3	C2	C5	F1	117.4°	120.0°
F3	C2	C5	C13	80.2°	120.0°
F3	C2	C5	C6	98.8°	60.3°
F4	C2	C5	F1	121.2°	120.0°
F4	C2	C5	C13	158.3°	0.0°
F4	C2	C5	C6	22.6°	179.7°
C2	C5	C13	C6	179.1°	179.7°
C2	C5	C13	C12	179.4°	179.7°
C2	C5	C6	C7	179.9°	179.7°
C2	C5	C6	H1	0.1°	0.4°
C2	C5	C13	H3	0.6°	0.3°
F1	C2	C5	C13	37.2°	120.0°
F1	C2	C5	C6	143.8°	59.7°
C5	C13	C12	H3	180.0°	180.0°
C13	C5	C6	C7	0.9°	0.1°
C5	C13	C12	C14	179.6°	180.0°
C5	C13	C12	C11	0.3°	0.0°
C13	C5	C6	H1	179.2°	179.9°
C6	C5	C13	C12	0.3°	0.0°
C5	C6	C7	H1	180.0°	179.9°
C5	C6	C7	C11	0.8°	0.0°
C5	C6	C7	N8	180.0°	180.0°
C6	C5	C13	H3	179.7°	180.0°
C13	C12	C14	C11	179.3°	180.0°
C13	C12	C14	O18	8.6°	130.1°
C13	C12	C14	C15	170.5°	50.1°
C13	C12	C11	C7	0.3°	0.0°
C13	C12	C11	C10	180.0°	180.0°
C6	C7	C11	C12	0.2°	0.0°
C6	C7	C11	N8	179.4°	180.0°
C6	C7	C11	C10	179.5°	180.0°
C6	C7	N8	C19	7.0°	0.0°
C6	C7	N8	C9	173.9°	180.0°
C12	C14	O18	C15	179.3°	179.9°
C12	C14	O18	C17	179.5°	179.8°
C14	C12	C11	C7	179.6°	180.0°
C12	C14	C15	N16	179.8°	180.0°
C14	C12	C11	C10	0.7°	0.0°
C14	C12	C13	H3	0.4°	0.0°
C12	C14	C15	H4	0.2°	0.2°
C11	C12	C14	O18	170.7°	49.9°
C11	C12	C14	C15	10.2°	130.0°
C12	C11	C7	C10	179.7°	180.0°
C12	C11	C7	N8	179.6°	180.0°
C12	C11	C10	C9	174.4°	179.9°
C12	C11	C10	H2	5.6°	0.0°
C11	C12	C13	H3	179.7°	180.0°
C14	O18	C17	N16	0.3°	0.4°
O18	C14	C15	N16	0.5°	0.1°
O18	C14	C15	H4	179.4°	179.7°
C14	O18	C17	H5	179.7°	180.0°
C17	O18	C14	C15	0.2°	0.3°
O18	C17	N16	H5	180.0°	179.6°
O18	C17	N16	C15	0.7°	0.3°
C14	C15	N16	C17	0.8°	0.2°
C14	C15	N16	H4	180.0°	179.8°
C17	N16	C15	H4	179.2°	180.0°
C11	C7	N8	C19	173.7°	180.0°
C11	C7	N8	C9	5.4°	0.0°
C7	C11	C10	C9	5.3°	0.0°
C11	C7	C6	H1	179.2°	179.9°
C7	C11	C10	H2	174.7°	180.0°
N8	C7	C11	C10	0.1°	0.0°
C7	N8	C19	O20	0.3°	0.0°
C7	N8	C19	C9	178.9°	180.0°
C7	N8	C19	C21	178.9°	180.0°
C7	N8	C9	C10	8.4°	0.0°
N8	C7	C6	H1	0.0°	0.1°
C7	N8	C9	H9	171.6°	180.0°
C15	N16	C17	H5	179.3°	180.0°
C11	C10	C9	N8	8.1°	0.0°
C11	C10	C9	H2	180.0°	180.0°
C11	C10	C9	H9	171.8°	180.0°
O20	C19	N8	C21	179.2°	180.0°
O20	C19	N8	C9	179.2°	180.0°
O20	C19	C21	C22	48.4°	43.6°
O20	C19	C21	C23	64.4°	25.0°
O20	C19	C21	H6	172.4°	170.7°
N8	C19	C21	C22	132.4°	136.4°
C19	N8	C9	C10	170.7°	180.0°
N8	C19	C21	C23	114.8°	155.0°
N8	C19	C21	H6	8.3°	9.3°
C19	N8	C9	H9	9.3°	0.0°
C9	N8	C19	C21	0.0°	0.0°
N8	C9	C10	H9	180.0°	180.0°
N8	C9	C10	H2	171.8°	180.0°
C21	C22	C23	H7	109.1°	107.5°
C21	C22	C23	H8	109.1°	107.5°
C22	C21	C19	C23	112.8°	68.6°
C22	C21	C19	H6	124.1°	145.6°
C22	C21	C23	H6	96.8°	107.5°
C21	C22	H7	H8	145.6°	145.7°
C21	C22	C23	H10	109.0°	107.5°
C21	C22	C23	H11	109.1°	107.4°
C23	C22	H7	H8	145.6°	145.7°
C22	C23	H10	H11	145.6°	145.7°
C19	C21	C23	H6	123.2°	145.1°
C19	C21	C22	H7	30.0°	0.0°
C19	C21	C22	H8	111.9°	145.0°
C19	C21	C23	H10	31.0°	145.0°
C19	C21	C23	H11	110.9°	0.0°
C21	C23	H10	H11	145.5°	145.6°
H2	C10	C9	H9	8.2°	0.0°
H6	C21	C22	H7	154.1°	145.0°
H6	C21	C22	H8	12.2°	0.0°
H6	C21	C23	H10	154.1°	0.1°
H6	C21	C23	H11	12.3°	145.0°
H7	C22	C23	H10	0.0°	145.0°
H7	C22	C23	H11	141.9°	0.1°
H8	C22	C23	H10	141.9°	0.0°
H8	C22	C23	H11	0.0°	145.1°

Release date:	2025-07-02
Definition date:	2025-03-06
Last modified:	2025-06-27
Release status:	REL
Processing site:	RCSB
Derived from:	9NNI