TY6

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O1	C09	sing	1.43Å	1.36Å
C04	N05	sing	1.47Å	1.40Å
C04	C03	sing	1.53Å	1.42Å
C09	O08	sing	1.43Å	1.44Å
C09	C22	sing	1.53Å	1.51Å
N05	N06	sing	1.45Å	1.40Å
O08	C03	sing	1.43Å	1.42Å
C03	C02	sing	1.53Å	1.52Å
O23	C22	sing	1.43Å	1.39Å
C22	C24	sing	1.53Å	1.46Å
C24	C02	sing	1.53Å	1.46Å
C24	O25	sing	1.43Å	1.40Å
O01	C02	sing	1.43Å	1.36Å
N06	N07	sing	1.45Å	1.38Å
C02	H1	sing	1.09Å	1.10Å
C03	H2	sing	1.09Å	1.10Å
C04	H3	sing	1.09Å	1.10Å
C04	H4	sing	1.09Å	1.10Å
C09	H5	sing	1.09Å	1.10Å
C22	H6	sing	1.09Å	1.10Å
C24	H7	sing	1.09Å	1.10Å
N05	H8	sing	1.01Å	1.00Å
N06	H9	sing	1.01Å	1.00Å
N07	H10	sing	1.01Å	1.00Å
N07	H11	sing	1.01Å	1.00Å
O01	H12	sing	0.97Å	0.95Å
O23	H13	sing	0.97Å	0.95Å
O25	H14	sing	0.97Å	0.95Å
O1	H15	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O1	C09	O08	108.1°	109.5°
O1	C09	C22	113.0°	109.5°
O1	C09	H5	108.6°	109.5°
C09	O1	H15	109.5°	114.0°
N05	C04	C03	110.0°	109.5°
C04	N05	N06	117.8°	111.0°
N05	C04	H3	109.3°	109.5°
N05	C04	H4	109.3°	109.5°
C04	N05	H8	107.4°	111.0°
C04	C03	O08	115.8°	109.5°
C04	C03	C02	117.8°	109.4°
C04	C03	H2	96.3°	109.5°
C03	C04	H3	109.3°	109.5°
C03	C04	H4	109.3°	109.4°
O08	C09	C22	112.5°	109.4°
C09	O08	C03	111.2°	114.1°
O08	C09	H5	107.6°	109.5°
C09	C22	O23	111.1°	109.5°
C09	C22	C24	112.3°	109.1°
C22	C09	H5	106.8°	109.5°
C09	C22	H6	105.9°	109.5°
N05	N06	N07	107.1°	111.0°
N06	N05	H8	107.3°	111.0°
N05	N06	H9	110.1°	111.0°
O08	C03	C02	123.0°	109.4°
O08	C03	H2	96.3°	109.5°
C03	C02	C24	112.7°	109.1°
C03	C02	O01	112.6°	109.6°
C03	C02	H1	104.5°	109.5°
C02	C03	H2	95.8°	109.5°
O23	C22	C24	113.4°	109.5°
O23	C22	H6	107.3°	109.6°
C22	O23	H13	109.5°	113.9°
C22	C24	C02	111.2°	109.1°
C22	C24	O25	114.3°	109.6°
C24	C22	H6	106.4°	109.5°
C22	C24	H7	107.2°	109.5°
C02	C24	O25	108.7°	109.6°
C24	C02	O01	114.7°	109.6°
C24	C02	H1	105.0°	109.5°
C02	C24	H7	107.2°	109.5°
O25	C24	H7	108.0°	109.6°
C24	O25	H14	109.5°	114.0°
O01	C02	H1	106.2°	109.5°
C02	O01	H12	109.5°	114.0°
N07	N06	H9	110.0°	111.0°
N06	N07	H10	109.5°	111.0°
N06	N07	H11	109.5°	111.0°
H3	C04	H4	109.4°	109.5°
H10	N07	H11	109.5°	111.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O1	C09	O08	C22	125.5°	120.0°
O1	C09	O08	H5	117.2°	120.0°
O1	C09	C22	H5	119.4°	120.0°
O1	C09	O08	C03	78.6°	178.8°
O1	C09	C22	O23	66.1°	57.8°
O1	C09	C22	C24	62.1°	177.6°
O1	C09	C22	H6	177.8°	62.5°
N05	C04	C03	H3	120.1°	120.0°
N05	C04	C03	H4	120.1°	120.0°
C04	N05	N06	H8	121.2°	124.0°
N05	C04	C03	O08	87.0°	60.1°
N05	C04	C03	C02	113.2°	180.0°
C04	N05	N06	N07	106.8°	125.0°
N05	C04	C03	H2	13.2°	60.0°
N05	C04	H3	H4	119.7°	120.0°
C04	N05	N06	H9	133.7°	111.0°
C04	C03	O08	C09	123.7°	178.9°
C03	C04	N05	N06	28.3°	180.0°
C04	C03	O08	C02	158.7°	119.9°
C04	C03	O08	H2	100.1°	120.1°
C04	C03	C02	H2	100.3°	120.0°
C04	C03	C02	C24	126.1°	177.6°
C04	C03	C02	O01	5.6°	57.6°
C04	C03	C02	H1	120.4°	62.5°
C03	C04	H3	H4	119.7°	120.0°
C03	C04	N05	H8	92.9°	56.0°
O08	C09	C22	H5	117.8°	120.0°
C09	O08	C03	C02	35.0°	61.2°
O08	C09	C22	O23	171.1°	62.3°
O08	C09	C22	C24	60.8°	57.6°
C09	O08	C03	H2	136.2°	58.9°
O08	C09	C22	H6	54.9°	177.5°
O08	C09	O1	H15	180.0°	59.9°
C22	C09	O08	C03	46.9°	61.2°
C09	C22	O23	C24	127.6°	119.6°
C09	C22	O23	H6	115.3°	120.2°
C09	C22	C24	H6	115.4°	119.9°
C09	C22	C24	C02	56.2°	57.0°
C09	C22	C24	O25	179.7°	62.9°
C09	C22	C24	H7	60.7°	176.9°
C09	C22	O23	H13	180.0°	60.1°
C22	C09	O1	H15	54.8°	179.9°
N05	N06	N07	H9	119.6°	124.0°
N06	N05	C04	H3	91.8°	60.0°
N06	N05	C04	H4	148.4°	60.0°
N05	N06	N07	H10	180.0°	180.0°
N05	N06	N07	H11	60.0°	56.0°
O08	C03	C02	H2	101.5°	120.0°
O08	C03	C02	C24	32.2°	57.6°
O08	C03	C02	O01	163.8°	62.3°
O08	C03	C02	H1	81.3°	177.5°
O08	C03	C04	H3	152.9°	60.0°
O08	C03	C04	H4	33.1°	179.9°
C03	O08	C09	H5	164.3°	58.8°
C03	C02	C24	C22	40.5°	57.0°
C03	C02	C24	O01	130.6°	120.0°
C03	C02	C24	H1	113.2°	119.9°
C03	C02	C24	O25	167.1°	62.9°
C03	C02	O01	H1	113.8°	120.2°
C02	C03	C04	H3	6.9°	60.0°
C02	C03	C04	H4	126.7°	60.0°
C03	C02	C24	H7	76.5°	176.9°
C03	C02	O01	H12	180.0°	179.8°
O23	C22	C24	H6	117.7°	120.3°
O23	C22	C24	C02	176.8°	62.8°
O23	C22	C24	O25	53.3°	177.2°
O23	C22	C09	H5	53.3°	177.8°
O23	C22	C24	H7	66.2°	57.0°
C22	C24	C02	O25	126.6°	120.0°
C22	C24	C02	H7	116.9°	119.8°
C22	C24	O25	H7	119.2°	120.2°
C22	C24	C02	O01	171.1°	62.9°
C22	C24	C02	H1	72.7°	176.9°
C24	C22	C09	H5	178.6°	62.4°
C24	C22	O23	H13	52.4°	179.7°
C22	C24	O25	H14	180.0°	59.9°
C02	C24	O25	H7	116.0°	120.2°
C24	C02	O01	H1	115.5°	120.2°
C24	C02	C03	H2	133.6°	62.4°
C02	C24	C22	H6	59.2°	176.9°
C24	C02	O01	H12	49.3°	60.1°
C02	C24	O25	H14	55.2°	179.5°
O25	C24	C02	O01	62.3°	177.1°
O25	C24	C02	H1	53.9°	57.0°
O25	C24	C22	H6	64.3°	57.0°
O01	C02	C03	H2	94.7°	177.7°
O01	C02	C24	H7	54.2°	56.9°
N07	N06	N05	H8	14.5°	1.0°
N06	N07	H10	H11	120.0°	124.0°
H1	C02	C03	H2	20.1°	57.5°
H1	C02	C24	H7	170.4°	63.2°
H1	C02	O01	H12	66.2°	60.0°
H2	C03	C04	H3	106.9°	180.0°
H2	C03	C04	H4	133.3°	60.0°
H3	C04	N05	H8	147.0°	176.1°
H4	C04	N05	H8	27.2°	64.0°
H5	C09	C22	H6	62.9°	57.5°
H5	C09	O1	H15	63.5°	60.1°
H6	C22	C24	H7	176.1°	63.3°
H6	C22	O23	H13	64.7°	60.2°
H7	C24	O25	H14	60.8°	60.3°
H8	N05	N06	H9	105.1°	125.0°
H9	N06	N07	H10	60.4°	56.0°
H9	N06	N07	H11	179.6°	179.9°

Release date:	2023-10-04
Definition date:	2023-05-11
Last modified:	2023-09-29
Release status:	REL
Processing site:	PDBJ
Derived from:	8JA9