X5Z

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C26	C22	sing	0.00Å	1.49Å
C27	C23	sing	0.00Å	1.48Å
C22	C23	doub	0.00Å	1.46Å
C22	N11	sing	0.00Å	1.28Å
C23	N12	sing	0.00Å	1.29Å
N11	O05	sing	0.00Å	1.35Å
N11	CO01	sing	0.00Å	1.90Å
N12	O06	sing	0.00Å	1.35Å
N12	CO01	sing	0.00Å	1.90Å
CO01	N10	sing	0.00Å	1.88Å
CO01	N09	sing	0.00Å	1.90Å
CO01	N13	sing	0.00Å	1.96Å
O04	N10	sing	0.00Å	1.33Å
N10	C21	sing	0.00Å	1.31Å
O03	N09	sing	0.00Å	1.33Å
N09	C20	sing	0.00Å	1.29Å
N13	N14	doub	0.00Å	1.13Å
C21	C20	doub	0.00Å	1.47Å
C21	C25	sing	0.00Å	1.48Å
C20	C24	sing	0.00Å	1.50Å
N14	N15	doub	0.00Å	1.19Å
C24	H1	sing	0.00Å	1.10Å
C24	H2	sing	0.00Å	1.10Å
C24	H3	sing	0.00Å	1.10Å
C25	H4	sing	0.00Å	1.10Å
C25	H5	sing	0.00Å	1.10Å
C25	H6	sing	0.00Å	1.10Å
C26	H7	sing	0.00Å	1.10Å
C26	H8	sing	0.00Å	1.10Å
C26	H9	sing	0.00Å	1.10Å
C27	H10	sing	0.00Å	1.10Å
C27	H11	sing	0.00Å	1.10Å
C27	H12	sing	0.00Å	1.10Å
O03	H14	sing	0.00Å	0.95Å
O04	H15	sing	0.00Å	0.95Å
O05	H16	sing	0.00Å	0.95Å
O06	H17	sing	0.00Å	0.95Å
CO01	N1	sing	0.00Å	51.48Å
N1	C2	sing	0.00Å	0.00Å	Aromatic
C2	C3	doub	0.00Å	0.00Å	Aromatic
C3	C4	sing	0.00Å	0.00Å	Aromatic
C4	C5	doub	0.00Å	0.00Å	Aromatic
C5	C6	sing	0.00Å	0.00Å	Aromatic
C6	N1	doub	0.00Å	0.00Å	Aromatic
C4	C7	sing	0.00Å	0.00Å
C7	C8	doub	0.00Å	0.00Å
C2	H18	sing	0.00Å	0.00Å
C3	H19	sing	0.00Å	0.00Å
C5	H20	sing	0.00Å	0.00Å
C6	H21	sing	0.00Å	0.00Å
C7	H22	sing	0.00Å	0.00Å
C8	H23	sing	0.00Å	0.00Å
C8	H24	sing	0.00Å	0.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C26	C22	C23	123.6°	90.0°
C26	C22	N11	123.6°	90.0°
C22	C26	H7	109.5°	90.0°
C22	C26	H8	109.5°	90.0°
C22	C26	H9	109.5°	90.0°
C27	C23	C22	123.3°	90.0°
C27	C23	N12	124.6°	90.0°
C23	C27	H10	109.5°	90.0°
C23	C27	H11	109.5°	90.0°
C23	C27	H12	109.4°	90.0°
C23	C22	N11	112.7°	90.0°
C22	C23	N12	112.2°	90.0°
C22	N11	O05	119.2°	90.0°
C22	N11	CO01	117.3°	90.0°
C23	N12	O06	119.5°	90.0°
C23	N12	CO01	117.5°	90.0°
O05	N11	CO01	123.4°	90.0°
N11	O05	H16	109.5°	90.0°
N11	CO01	N12	80.2°	90.0°
N11	CO01	N10	98.5°	90.0°
N11	CO01	N09	179.2°	90.0°
N11	CO01	N13	88.2°	90.0°
N11	CO01	N1	17.8°	90.0°
O06	N12	CO01	123.0°	90.0°
N12	O06	H17	109.5°	90.0°
N12	CO01	N10	178.7°	90.0°
N12	CO01	N09	99.2°	90.0°
N12	CO01	N13	92.4°	90.0°
N12	CO01	N1	82.8°	90.0°
N10	CO01	N09	82.1°	90.0°
N10	CO01	N13	87.2°	90.0°
CO01	N10	O04	122.0°	90.0°
CO01	N10	C21	116.3°	90.0°
N10	CO01	N1	96.1°	90.0°
N09	CO01	N13	91.5°	90.0°
CO01	N09	O03	121.9°	90.0°
CO01	N09	C20	115.5°	90.0°
N09	CO01	N1	162.6°	90.0°
CO01	N13	N14	116.3°	90.0°
N13	CO01	N1	105.7°	90.0°
O04	N10	C21	121.6°	90.0°
N10	O04	H15	109.5°	90.0°
N10	C21	C20	112.3°	90.0°
N10	C21	C25	122.7°	90.0°
O03	N09	C20	122.6°	90.0°
N09	O03	H14	109.5°	90.0°
N09	C20	C21	113.6°	90.0°
N09	C20	C24	123.6°	90.0°
N13	N14	N15	173.2°	90.0°
C20	C21	C25	125.0°	90.0°
C21	C20	C24	122.7°	90.0°
C21	C25	H4	109.5°	90.0°
C21	C25	H5	109.5°	90.0°
C21	C25	H6	109.5°	90.0°
C20	C24	H1	109.5°	90.0°
C20	C24	H2	109.5°	90.0°
C20	C24	H3	109.5°	90.0°
H1	C24	H2	109.4°	90.0°
H1	C24	H3	109.5°	90.0°
H2	C24	H3	109.4°	90.0°
H4	C25	H5	109.5°	90.0°
H4	C25	H6	109.5°	90.0°
H5	C25	H6	109.5°	90.0°
H7	C26	H8	109.4°	90.0°
H7	C26	H9	109.4°	90.0°
H8	C26	H9	109.5°	90.0°
H10	C27	H11	109.5°	90.0°
H10	C27	H12	109.5°	90.0°
H11	C27	H12	109.4°	90.0°
CO01	N1	C2	90.0°	90.0°
CO01	N1	C6	90.0°	90.0°
N1	C2	C3	90.0°	90.0°
C2	N1	C6	90.0°	90.0°
N1	C2	H18	90.0°	90.0°
C2	C3	C4	90.0°	90.0°
C3	C2	H18	90.0°	90.0°
C2	C3	H19	90.0°	90.0°
C3	C4	C5	90.0°	90.0°
C3	C4	C7	90.0°	90.0°
C4	C3	H19	90.0°	90.0°
C4	C5	C6	90.0°	90.0°
C5	C4	C7	90.0°	90.0°
C4	C5	H20	90.0°	90.0°
C5	C6	N1	90.0°	90.0°
C6	C5	H20	90.0°	90.0°
C5	C6	H21	90.0°	90.0°
N1	C6	H21	90.0°	90.0°
C4	C7	C8	90.0°	90.0°
C4	C7	H22	90.0°	90.0°
C8	C7	H22	90.0°	90.0°
C7	C8	H23	90.0°	90.0°
C7	C8	H24	90.0°	90.0°
H23	C8	H24	90.0°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C26	C22	C23	C27	4.3°	90.0°
C26	C22	C23	N11	178.6°	90.0°
C26	C22	C23	N12	176.1°	90.0°
C26	C22	N11	O05	2.1°	90.0°
C26	C22	N11	CO01	175.7°	90.0°
C22	C26	H7	H8	120.0°	90.0°
C22	C26	H7	H9	120.0°	90.0°
C22	C26	H8	H9	120.0°	90.0°
C27	C23	C22	N12	179.6°	90.0°
C27	C23	C22	N11	177.1°	90.0°
C27	C23	N12	O06	0.9°	90.0°
C27	C23	N12	CO01	178.6°	90.0°
C23	C27	H10	H11	120.0°	90.0°
C23	C27	H10	H12	120.0°	90.0°
C23	C27	H11	H12	119.9°	90.0°
C23	C22	N11	O05	179.2°	90.0°
C23	C22	N11	CO01	2.9°	90.0°
C22	C23	N12	O06	179.5°	90.0°
C22	C23	N12	CO01	1.1°	90.0°
C23	C22	C26	H7	180.0°	90.0°
C23	C22	C26	H8	60.0°	90.0°
C23	C22	C26	H9	60.0°	90.0°
C22	C23	C27	H10	180.0°	90.0°
C22	C23	C27	H11	60.0°	90.0°
C22	C23	C27	H12	60.0°	90.0°
N11	C22	C23	N12	2.5°	90.0°
C22	N11	O05	CO01	177.8°	90.0°
C22	N11	CO01	N12	1.9°	90.0°
C22	N11	CO01	N10	178.5°	90.0°
C22	N11	CO01	N09	29.3°	90.0°
C22	N11	CO01	N13	94.7°	90.0°
N11	C22	C26	H7	1.5°	90.0°
N11	C22	C26	H8	121.5°	90.0°
N11	C22	C26	H9	118.5°	90.0°
C22	N11	O05	H16	180.0°	90.0°
C22	N11	CO01	N1	95.0°	90.0°
C23	N12	CO01	N11	0.3°	90.0°
C23	N12	O06	CO01	179.4°	90.0°
C23	N12	CO01	N10	14.7°	90.0°
C23	N12	CO01	N09	179.9°	90.0°
C23	N12	CO01	N13	88.0°	90.0°
N12	C23	C27	H10	0.4°	90.0°
N12	C23	C27	H11	120.4°	90.0°
N12	C23	C27	H12	119.6°	90.0°
C23	N12	O06	H17	180.0°	90.0°
C23	N12	CO01	N1	17.5°	90.0°
O05	N11	CO01	N12	179.7°	90.0°
O05	N11	CO01	N10	0.7°	90.0°
O05	N11	CO01	N09	152.9°	90.0°
O05	N11	CO01	N13	87.5°	90.0°
O05	N11	CO01	N1	82.8°	90.0°
N11	CO01	N12	O06	179.1°	90.0°
N11	CO01	N12	N10	14.4°	90.0°
N11	CO01	N12	N09	179.6°	90.0°
N11	CO01	N12	N13	87.7°	90.0°
N11	CO01	N12	N1	17.8°	90.0°
N11	CO01	N10	N09	179.6°	90.0°
N11	CO01	N10	N13	87.8°	90.0°
N11	CO01	N10	N1	17.8°	90.0°
N11	CO01	N09	N13	65.3°	90.0°
N11	CO01	N09	N1	122.4°	90.0°
N11	CO01	N13	N1	3.1°	90.0°
N11	CO01	N10	O04	1.8°	90.0°
N11	CO01	N10	C21	178.8°	90.0°
N11	CO01	N09	O03	27.2°	90.0°
N11	CO01	N09	C20	153.8°	90.0°
N11	CO01	N13	N14	119.3°	90.0°
CO01	N11	O05	H16	2.3°	90.0°
N11	CO01	N1	C2	90.0°	90.0°
N11	CO01	N1	C6	90.0°	90.0°
O06	N12	CO01	N10	164.8°	90.0°
O06	N12	CO01	N09	0.5°	90.0°
O06	N12	CO01	N13	91.4°	90.0°
O06	N12	CO01	N1	163.0°	90.0°
N12	CO01	N10	N09	165.3°	90.0°
N12	CO01	N10	N13	73.4°	90.0°
N12	CO01	N10	N1	32.1°	90.0°
N12	CO01	N09	N13	92.7°	90.0°
N12	CO01	N09	N1	95.0°	90.0°
N12	CO01	N13	N1	83.2°	90.0°
N12	CO01	N10	O04	12.5°	90.0°
N12	CO01	N10	C21	164.5°	90.0°
N12	CO01	N09	O03	0.2°	90.0°
N12	CO01	N09	C20	178.8°	90.0°
N12	CO01	N13	N14	39.2°	90.0°
CO01	N12	O06	H17	0.6°	90.0°
N12	CO01	N1	C2	90.0°	90.0°
N12	CO01	N1	C6	90.0°	90.0°
N10	CO01	N09	N13	86.9°	90.0°
N10	CO01	N09	N1	85.4°	90.0°
N10	CO01	N13	N1	95.6°	90.0°
CO01	N10	O04	C21	176.8°	90.0°
N10	CO01	N09	O03	179.4°	90.0°
N10	CO01	N09	C20	1.5°	90.0°
N10	CO01	N13	N14	142.1°	90.0°
CO01	N10	C21	C20	2.8°	90.0°
CO01	N10	C21	C25	175.7°	90.0°
CO01	N10	O04	H15	180.0°	90.0°
N10	CO01	N1	C2	90.0°	90.0°
N10	CO01	N1	C6	90.0°	90.0°
N09	CO01	N13	N1	177.6°	90.0°
N09	CO01	N10	O04	177.8°	90.0°
N09	CO01	N10	C21	0.9°	90.0°
CO01	N09	O03	C20	179.0°	90.0°
N09	CO01	N13	N14	60.0°	90.0°
CO01	N09	C20	C21	3.3°	90.0°
CO01	N09	C20	C24	176.1°	90.0°
CO01	N09	O03	H14	180.0°	90.0°
N09	CO01	N1	C2	90.0°	90.0°
N09	CO01	N1	C6	90.0°	90.0°
N13	CO01	N10	O04	85.9°	90.0°
N13	CO01	N10	C21	91.0°	90.0°
N13	CO01	N09	O03	92.5°	90.0°
N13	CO01	N09	C20	88.5°	90.0°
CO01	N13	N14	N15	174.2°	90.0°
N13	CO01	N1	C2	90.0°	90.0°
N13	CO01	N1	C6	90.0°	90.0°
O04	N10	C21	C20	179.7°	90.0°
O04	N10	C21	C25	1.2°	90.0°
O04	N10	CO01	N1	19.6°	90.0°
N10	C21	C20	N09	4.0°	90.0°
N10	C21	C20	C25	178.5°	90.0°
N10	C21	C20	C24	175.5°	90.0°
N10	C21	C25	H4	180.0°	90.0°
N10	C21	C25	H5	60.0°	90.0°
N10	C21	C25	H6	60.0°	90.0°
C21	N10	O04	H15	3.3°	90.0°
C21	N10	CO01	N1	163.4°	90.0°
O03	N09	C20	C21	177.6°	90.0°
O03	N09	C20	C24	2.9°	90.0°
O03	N09	CO01	N1	95.2°	90.0°
N09	C20	C21	C24	179.5°	90.0°
N09	C20	C21	C25	174.5°	90.0°
N09	C20	C24	H1	180.0°	90.0°
N09	C20	C24	H2	60.0°	90.0°
N09	C20	C24	H3	60.0°	90.0°
C20	N09	O03	H14	1.0°	90.0°
C20	N09	CO01	N1	83.8°	90.0°
N14	N13	CO01	N1	122.3°	90.0°
C21	C20	C24	H1	0.6°	90.0°
C21	C20	C24	H2	119.4°	90.0°
C21	C20	C24	H3	120.6°	90.0°
C20	C21	C25	H4	1.7°	90.0°
C20	C21	C25	H5	118.3°	90.0°
C20	C21	C25	H6	121.7°	90.0°
C25	C21	C20	C24	6.0°	90.0°
C21	C25	H4	H5	120.0°	90.0°
C21	C25	H4	H6	120.0°	90.0°
C21	C25	H5	H6	120.0°	90.0°
C20	C24	H1	H2	120.0°	90.0°
C20	C24	H1	H3	120.0°	90.0°
C20	C24	H2	H3	120.0°	90.0°
H1	C24	H2	H3	120.0°	90.0°
H4	C25	H5	H6	120.0°	90.0°
H7	C26	H8	H9	119.9°	90.0°
H10	C27	H11	H12	120.0°	90.0°
CO01	N1	C2	C6	90.0°	90.0°
CO01	N1	C2	C3	90.0°	90.0°
CO01	N1	C6	C5	90.0°	90.0°
CO01	N1	C2	H18	90.0°	90.0°
CO01	N1	C6	H21	90.0°	90.0°
N1	C2	C3	H18	90.0°	90.0°
N1	C2	C3	C4	90.0°	90.0°
C2	N1	C6	C5	90.0°	90.0°
N1	C2	C3	H19	90.0°	90.0°
C2	N1	C6	H21	90.0°	90.0°
C2	C3	C4	H19	90.0°	90.0°
C2	C3	C4	C5	90.0°	90.0°
C3	C2	N1	C6	90.0°	90.0°
C2	C3	C4	C7	90.0°	90.0°
C3	C4	C5	C7	90.0°	90.0°
C3	C4	C5	C6	90.0°	90.0°
C3	C4	C7	C8	90.0°	90.0°
C4	C3	C2	H18	90.0°	90.0°
C3	C4	C5	H20	90.0°	90.0°
C3	C4	C7	H22	90.0°	90.0°
C4	C5	C6	H20	90.0°	90.0°
C4	C5	C6	N1	90.0°	90.0°
C5	C4	C7	C8	90.0°	90.0°
C5	C4	C3	H19	90.0°	90.0°
C4	C5	C6	H21	90.0°	90.0°
C5	C4	C7	H22	90.0°	90.0°
C5	C6	N1	H21	90.0°	90.0°
C6	C5	C4	C7	90.0°	90.0°
C6	N1	C2	H18	90.0°	90.0°
N1	C6	C5	H20	90.0°	90.0°
C4	C7	C8	H22	90.0°	90.0°
C7	C4	C3	H19	90.0°	90.0°
C7	C4	C5	H20	90.0°	90.0°
C4	C7	C8	H23	90.0°	90.0°
C4	C7	C8	H24	90.0°	90.0°
C7	C8	H23	H24	90.0°	90.0°
H18	C2	C3	H19	90.0°	90.0°
H20	C5	C6	H21	90.0°	90.0°
H22	C7	C8	H23	90.0°	90.0°
H22	C7	C8	H24	90.0°	90.0°

Release date:	2022-11-23
Definition date:	2022-10-31
Last modified:	2024-02-07
Release status:	REL
Processing site:	RCSB
Derived from:	8EYZ