A1AXK

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O1	C1	sing	1.43Å	1.42Å
C1	C2	sing	1.53Å	1.51Å
C2	N1	sing	1.46Å	1.45Å
N1	C3	sing	1.35Å	1.33Å
C3	S1	doub	1.71Å	1.68Å
C3	N2	sing	1.35Å	1.36Å
N2	C4	sing	1.47Å	1.46Å
C4	C5	sing	1.55Å	1.55Å
C5	C6	sing	1.56Å	1.54Å
C6	C7	sing	1.57Å	1.52Å
C7	C8	sing	1.57Å	1.53Å
C8	C9	sing	1.53Å	1.51Å
C9	C10	doub	1.32Å	1.31Å
C4	C8	sing	1.56Å	1.57Å
C6	C10	sing	1.53Å	1.51Å
C1	H2	sing	1.09Å	1.10Å
C1	H3	sing	1.09Å	1.10Å
C10	H16	sing	1.08Å	1.08Å
C2	H5	sing	1.09Å	1.10Å
C2	H4	sing	1.09Å	1.10Å
C4	H8	sing	1.09Å	1.10Å
C5	H9	sing	1.09Å	1.10Å
C5	H10	sing	1.09Å	1.10Å
C6	H11	sing	1.09Å	1.10Å
C7	H12	sing	1.09Å	1.10Å
C7	H13	sing	1.09Å	1.10Å
C8	H14	sing	1.09Å	1.10Å
C9	H15	sing	1.08Å	1.08Å
N1	H6	sing	0.97Å	1.00Å
N2	H7	sing	0.97Å	1.00Å
O1	H1	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O1	C1	C2	110.6°	109.5°
O1	C1	H2	109.1°	109.4°
O1	C1	H3	109.2°	109.5°
C1	O1	H1	109.5°	114.0°
C1	C2	N1	112.5°	109.5°
C2	C1	H2	109.2°	109.5°
C2	C1	H3	109.2°	109.5°
C1	C2	H5	108.7°	109.5°
C1	C2	H4	108.7°	109.5°
C2	N1	C3	125.1°	120.0°
N1	C2	H5	108.7°	109.5°
N1	C2	H4	108.7°	109.4°
C2	N1	H6	117.5°	120.0°
N1	C3	S1	119.7°	120.0°
N1	C3	N2	122.0°	120.0°
C3	N1	H6	117.5°	120.0°
S1	C3	N2	118.2°	120.0°
C3	N2	C4	127.2°	120.0°
C3	N2	H7	116.4°	120.0°
N2	C4	C5	109.7°	110.6°
N2	C4	C8	124.4°	110.6°
N2	C4	H8	107.8°	110.6°
C4	N2	H7	116.4°	120.0°
C4	C5	C6	104.1°	103.7°
C5	C4	C8	100.4°	103.7°
C5	C4	H8	106.7°	110.6°
C4	C5	H9	110.8°	110.6°
C4	C5	H10	110.8°	110.6°
C5	C6	C7	99.1°	100.4°
C5	C6	C10	106.5°	104.1°
C6	C5	H9	110.8°	110.6°
C6	C5	H10	110.8°	110.6°
C5	C6	H11	115.3°	116.3°
C6	C7	C8	93.0°	93.3°
C7	C6	C10	102.2°	99.8°
C7	C6	H11	115.7°	117.3°
C6	C7	H12	113.4°	112.6°
C6	C7	H13	113.4°	112.5°
C7	C8	C9	101.1°	99.9°
C7	C8	C4	100.6°	100.4°
C8	C7	H12	113.4°	112.5°
C8	C7	H13	113.4°	112.5°
C7	C8	H14	115.9°	116.7°
C8	C9	C10	108.0°	108.4°
C9	C8	C4	105.7°	103.9°
C9	C8	H14	116.3°	117.0°
C8	C9	H15	126.0°	125.8°
C9	C10	C6	106.8°	108.4°
C9	C10	H16	126.6°	125.8°
C10	C9	H15	126.0°	125.8°
C8	C4	H8	106.6°	110.6°
C4	C8	H14	115.3°	116.3°
C6	C10	H16	126.6°	125.8°
C10	C6	H11	115.9°	116.3°
H2	C1	H3	109.5°	109.5°
H5	C2	H4	109.5°	109.4°
H9	C5	H10	109.5°	110.6°
H12	C7	H13	109.5°	112.1°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O1	C1	C2	H2	120.1°	119.9°
O1	C1	C2	H3	120.2°	120.0°
O1	C1	C2	N1	62.6°	65.0°
O1	C1	H2	H3	119.4°	120.0°
O1	C1	C2	H5	177.0°	174.9°
O1	C1	C2	H4	57.8°	55.0°
C1	C2	N1	H5	120.4°	120.0°
C1	C2	N1	H4	120.5°	120.0°
C1	C2	N1	C3	129.7°	180.0°
C2	C1	H2	H3	119.5°	120.0°
C1	C2	H5	H4	118.6°	120.0°
C1	C2	N1	H6	50.3°	0.1°
C2	C1	O1	H1	180.0°	179.9°
C2	N1	C3	H6	180.0°	179.9°
C2	N1	C3	S1	1.5°	0.0°
C2	N1	C3	N2	177.1°	180.0°
N1	C2	C1	H2	57.5°	175.1°
N1	C2	C1	H3	177.2°	55.0°
N1	C2	H5	H4	118.6°	120.0°
N1	C3	S1	N2	178.7°	180.0°
N1	C3	N2	C4	2.8°	180.0°
C3	N1	C2	H5	9.3°	59.9°
C3	N1	C2	H4	109.8°	60.0°
N1	C3	N2	H7	177.2°	0.0°
S1	C3	N2	C4	175.8°	0.0°
S1	C3	N1	H6	178.4°	179.9°
S1	C3	N2	H7	4.2°	180.0°
C3	N2	C4	H7	180.0°	179.9°
C3	N2	C4	C5	120.9°	86.4°
C3	N2	C4	C8	2.4°	159.3°
C3	N2	C4	H8	123.2°	36.4°
N2	C3	N1	H6	2.9°	0.1°
N2	C4	C5	C8	132.5°	118.6°
N2	C4	C5	H8	116.5°	122.9°
N2	C4	C5	C6	134.2°	118.5°
N2	C4	C8	C7	86.5°	82.2°
N2	C4	C8	C9	168.7°	174.7°
N2	C4	C8	H8	126.2°	122.8°
N2	C4	C5	H9	106.7°	122.8°
N2	C4	C5	H10	15.0°	0.0°
N2	C4	C8	H14	38.8°	44.6°
C4	C5	C6	H9	119.1°	118.6°
C4	C5	C6	H10	119.2°	118.5°
C4	C5	C6	C7	39.3°	36.3°
C5	C4	C8	C7	36.2°	36.4°
C5	C4	C8	C9	68.6°	66.7°
C5	C4	C8	H8	111.1°	118.5°
C4	C5	C6	C10	66.5°	66.7°
C4	C5	H9	H10	122.5°	122.8°
C4	C5	C6	H11	163.4°	164.0°
C5	C4	C8	H14	161.6°	163.2°
C5	C4	N2	H7	59.1°	93.5°
C5	C6	C7	C10	109.2°	106.4°
C5	C6	C7	H11	123.9°	127.0°
C5	C6	C7	C8	60.3°	57.0°
C5	C6	C10	C9	70.4°	69.9°
C6	C5	C4	C8	1.7°	0.1°
C5	C6	C10	H11	129.7°	129.3°
C5	C6	C10	H16	109.6°	109.9°
C6	C5	C4	H8	109.3°	118.6°
C6	C5	H9	H10	122.5°	122.8°
C5	C6	C7	H12	177.5°	173.0°
C5	C6	C7	H13	56.8°	59.1°
C6	C7	C8	H12	117.2°	116.1°
C6	C7	C8	H13	117.2°	116.1°
C6	C7	C8	C9	48.3°	49.3°
C7	C6	C10	C9	33.0°	33.6°
C6	C7	C8	C4	60.2°	57.0°
C7	C6	C10	H11	126.8°	127.3°
C7	C6	C10	H16	147.0°	146.6°
C7	C6	C5	H9	158.4°	154.9°
C7	C6	C5	H10	79.9°	82.3°
C6	C7	H12	H13	127.8°	128.1°
C6	C7	C8	H14	174.9°	176.4°
C7	C8	C9	C4	104.4°	103.4°
C7	C8	C9	H14	126.3°	126.9°
C7	C8	C9	C10	32.5°	33.0°
C7	C8	C4	H14	125.4°	126.8°
C8	C7	C6	C10	48.9°	49.4°
C7	C8	C4	H8	147.3°	154.9°
C8	C7	C6	H11	175.8°	176.0°
C8	C7	H12	H13	127.8°	128.0°
C7	C8	C9	H15	147.5°	146.8°
C8	C9	C10	H15	180.0°	179.8°
C9	C8	C4	H14	129.8°	130.1°
C8	C9	C10	C6	0.0°	0.4°
C8	C9	C10	H16	180.0°	179.8°
C9	C8	C4	H8	42.5°	51.8°
C9	C8	C7	H12	68.9°	66.8°
C9	C8	C7	H13	165.4°	165.4°
C10	C9	C8	C4	71.9°	70.4°
C9	C10	C6	H16	180.0°	179.8°
C9	C10	C6	H11	159.8°	160.8°
C10	C9	C8	H14	158.8°	159.9°
C8	C4	C5	H9	120.8°	118.6°
C8	C4	C5	H10	117.5°	118.6°
C4	C8	C7	H12	177.4°	173.1°
C4	C8	C7	H13	57.0°	59.1°
C4	C8	C9	H15	108.1°	109.8°
C8	C4	N2	H7	177.6°	20.8°
C10	C6	C5	H9	52.7°	51.9°
C10	C6	C5	H10	174.4°	174.8°
C10	C6	C7	H12	68.3°	66.6°
C10	C6	C7	H13	166.0°	165.5°
C6	C10	C9	H15	180.0°	179.9°
H2	C1	C2	H5	62.9°	55.0°
H2	C1	C2	H4	178.0°	65.0°
H2	C1	O1	H1	59.8°	60.1°
H3	C1	C2	H5	56.8°	65.0°
H3	C1	C2	H4	62.4°	175.0°
H3	C1	O1	H1	59.8°	59.9°
H16	C10	C6	H11	20.2°	19.4°
H16	C10	C9	H15	0.0°	0.1°
H5	C2	N1	H6	170.8°	120.0°
H4	C2	N1	H6	70.1°	120.1°
H8	C4	C5	H9	9.8°	0.0°
H8	C4	C5	H10	131.5°	122.9°
H8	C4	C8	H14	87.3°	78.3°
H8	C4	N2	H7	56.8°	143.6°
H9	C5	C6	H11	77.4°	77.4°
H10	C5	C6	H11	44.3°	45.5°
H11	C6	C7	H12	58.7°	59.9°
H11	C6	C7	H13	67.0°	67.9°
H12	C7	C8	H14	57.7°	60.3°
H13	C7	C8	H14	68.0°	67.5°
H14	C8	C9	H15	21.2°	19.8°

Release date:	2025-03-26
Definition date:	2024-07-11
Last modified:	2025-03-21
Release status:	REL
Processing site:	RCSB
Derived from:	7HAE