Summary Geometry PCM/PTM Related PDB entries

DVW

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C11	C12	doub	1.39Å	1.53Å
C11	PT	sing	2.03Å	2.37Å
C12	PT	sing	2.00Å	2.12Å
PT	N1	sing	2.07Å	2.05Å
PT	N10	sing	2.03Å	2.17Å
PT	N3	sing	2.02Å	1.84Å
C7	C6A	doub	1.40Å	1.37Å	Aromatic
C7	C8	sing	1.36Å	1.36Å	Aromatic
C6A	C6	sing	1.43Å	1.37Å	Aromatic
C6A	C10	sing	1.42Å	1.42Å	Aromatic
C6	C5	doub	1.34Å	1.37Å	Aromatic
C5	C4A	sing	1.43Å	1.39Å	Aromatic
C4A	C4	doub	1.40Å	1.40Å	Aromatic
C4A	C1A	sing	1.42Å	1.41Å	Aromatic
C4	C3	sing	1.36Å	1.38Å	Aromatic
C3	C2	doub	1.42Å	1.38Å	Aromatic
C2	N1	sing	1.34Å	1.41Å	Aromatic
C2	C2A	sing	1.50Å	1.50Å
N1	C1A	doub	1.37Å	1.32Å	Aromatic
C1A	C10	sing	1.45Å	1.42Å	Aromatic
C10	N10	doub	1.36Å	1.44Å	Aromatic
N10	C9	sing	1.34Å	1.35Å	Aromatic
C9	C8	doub	1.41Å	1.38Å	Aromatic
C9	C9A	sing	1.50Å	1.46Å
CA	CB	doub	1.37Å	1.12Å	Aromatic
CB	C52	sing	1.46Å	1.15Å
CM1	N12	sing	1.46Å	1.47Å
N12	C52	sing	1.39Å	1.36Å	Aromatic
N12	C22	sing	1.35Å	1.35Å	Aromatic
C52	C42	doub	1.37Å	1.40Å	Aromatic
C42	N3	sing	1.35Å	1.32Å	Aromatic
N3	C22	doub	1.32Å	1.34Å	Aromatic
C11	H1	sing	0.98Å	1.10Å
C11	H2	sing	0.98Å	1.10Å
C12	H3	sing	0.98Å	1.10Å
C12	H4	sing	0.98Å	1.10Å
C7	H5	sing	0.95Å	1.08Å
C6	H6	sing	0.94Å	1.08Å
C5	H7	sing	0.94Å	1.08Å
C4	H8	sing	0.95Å	1.08Å
C3	H9	sing	0.94Å	1.08Å
C8	H10	sing	0.94Å	1.08Å
C2A	H11	sing	0.97Å	1.10Å
C2A	H12	sing	0.97Å	1.10Å
C2A	H13	sing	0.97Å	1.10Å
C9A	H14	sing	0.97Å	1.10Å
C9A	H15	sing	0.97Å	1.10Å
C9A	H16	sing	0.97Å	1.10Å
CA	H17	sing	0.94Å	1.08Å
CM1	H20	sing	0.97Å	1.10Å
CM1	H21	sing	0.97Å	1.10Å
CM1	H22	sing	0.97Å	1.10Å
C42	H23	sing	0.93Å	1.08Å
C22	H24	sing	0.95Å	1.08Å
CB	N2	sing	1.37Å	95.57Å	Aromatic
N2	N4	doub	1.31Å	0.00Å	Aromatic
N4	N5	sing	1.34Å	0.00Å	Aromatic
N5	CA	sing	1.34Å	95.18Å	Aromatic
N5	C1	sing	1.47Å	0.00Å
C1	C13	sing	1.54Å	0.00Å
C13	C14	sing	1.52Å	0.00Å
C14	C15	sing	1.53Å	0.00Å
C15	C16	sing	1.54Å	0.00Å
C16	O1	sing	1.43Å	0.00Å
O1	C1	sing	1.45Å	0.00Å
C13	O3	sing	1.42Å	0.00Å
C14	O2	sing	1.43Å	0.00Å
C15	O4	sing	1.43Å	0.00Å
C16	O5	sing	1.40Å	0.00Å
C1	H18	sing	0.99Å	0.00Å
C13	H19	sing	0.98Å	0.00Å
C14	H25	sing	0.99Å	0.00Å
C15	H26	sing	0.99Å	0.00Å
C16	H27	sing	0.99Å	0.00Å
O3	H28	sing	0.84Å	0.00Å
O2	H29	sing	0.84Å	0.00Å
O4	H30	sing	0.84Å	0.00Å
O5	H31	sing	0.84Å	0.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C12	C11	PT	61.4°	68.9°
C11	C12	PT	79.4°	70.9°
C12	C11	H1	119.8°	121.3°
C12	C11	H2	119.7°	120.1°
C11	C12	H3	116.4°	119.6°
C11	C12	H4	116.4°	121.1°
C11	PT	C12	39.2°	40.2°
C11	PT	N1	167.3°	156.4°
C11	PT	N10	98.9°	118.7°
C11	PT	N3	95.9°	87.2°
PT	C11	H1	119.8°	103.5°
PT	C11	H2	119.8°	98.3°
C12	PT	N1	128.1°	117.2°
C12	PT	N10	137.6°	158.9°
C12	PT	N3	93.7°	89.1°
PT	C12	H3	116.4°	97.9°
PT	C12	H4	116.4°	101.8°
N1	PT	N10	93.7°	83.6°
N1	PT	N3	83.9°	101.2°
PT	N1	C2	134.6°	132.9°
PT	N1	C1A	100.7°	108.1°
N10	PT	N3	83.3°	90.7°
PT	N10	C10	91.3°	109.4°
PT	N10	C9	152.4°	131.2°
PT	N3	C42	126.8°	109.1°
PT	N3	C22	117.7°	138.3°
C6A	C7	C8	119.3°	119.8°
C7	C6A	C6	111.4°	122.7°
C7	C6A	C10	122.3°	117.3°
C6A	C7	H5	120.4°	120.0°
C7	C8	C9	119.3°	120.1°
C8	C7	H5	120.4°	120.2°
C7	C8	H10	120.3°	120.3°
C6	C6A	C10	126.3°	119.9°
C6A	C6	C5	119.7°	121.2°
C6A	C6	H6	120.2°	119.2°
C6A	C10	C1A	112.2°	118.9°
C6A	C10	N10	117.6°	122.8°
C6	C5	C4A	118.2°	121.1°
C5	C6	H6	120.1°	119.6°
C6	C5	H7	120.9°	119.7°
C5	C4A	C4	114.4°	122.7°
C5	C4A	C1A	121.5°	120.0°
C4A	C5	H7	120.9°	119.2°
C4	C4A	C1A	124.1°	117.3°
C4A	C4	C3	119.6°	119.8°
C4A	C4	H8	120.2°	120.0°
C4A	C1A	N1	114.1°	123.0°
C4A	C1A	C10	122.1°	118.9°
C4	C3	C2	116.5°	120.1°
C3	C4	H8	120.2°	120.2°
C4	C3	H9	121.7°	120.3°
C3	C2	N1	121.5°	121.9°
C3	C2	C2A	118.8°	119.7°
C2	C3	H9	121.7°	119.6°
N1	C2	C2A	119.6°	118.4°
C2	N1	C1A	124.0°	117.8°
C2	C2A	H11	109.5°	109.7°
C2	C2A	H12	109.4°	110.1°
C2	C2A	H13	109.4°	109.7°
N1	C1A	C10	123.7°	118.1°
C1A	C10	N10	130.0°	118.3°
C10	N10	C9	116.2°	118.2°
N10	C9	C8	124.8°	121.8°
N10	C9	C9A	124.5°	118.1°
C8	C9	C9A	110.6°	120.1°
C9	C8	H10	120.3°	119.7°
C9	C9A	H14	109.5°	110.0°
C9	C9A	H15	109.5°	109.6°
C9	C9A	H16	109.5°	109.8°
CA	CB	C52	126.1°	125.3°
CB	CA	H17	124.8°	127.5°
CA	CB	N2	68.9°	106.7°
CB	CA	N5	110.5°	106.8°
CB	C52	N12	133.1°	135.1°
CB	C52	C42	121.7°	120.1°
C52	CB	N2	60.5°	128.0°
CM1	N12	C52	129.4°	128.2°
CM1	N12	C22	121.2°	125.5°
N12	CM1	H20	109.5°	109.6°
N12	CM1	H21	109.5°	109.5°
N12	CM1	H22	109.5°	109.5°
C52	N12	C22	109.4°	106.3°
N12	C52	C42	104.9°	104.8°
N12	C22	N3	107.8°	112.6°
N12	C22	H24	126.1°	122.9°
C52	C42	N3	109.0°	111.6°
C52	C42	H23	125.5°	125.2°
C42	N3	C22	108.8°	104.5°
N3	C42	H23	125.5°	123.1°
N3	C22	H24	126.1°	124.4°
H1	C11	H2	109.5°	118.5°
H3	C12	H4	109.5°	119.3°
H11	C2A	H12	109.5°	108.5°
H11	C2A	H13	109.5°	109.6°
H12	C2A	H13	109.5°	109.2°
H14	C9A	H15	109.5°	108.4°
H14	C9A	H16	109.4°	109.3°
H15	C9A	H16	109.5°	109.7°
H17	CA	N5	124.7°	125.8°
H20	CM1	H21	109.4°	109.4°
H20	CM1	H22	109.5°	109.4°
H21	CM1	H22	109.5°	109.4°
CB	N2	N4	90.0°	109.1°
N2	N4	N5	90.0°	108.1°
N4	N5	CA	90.0°	109.3°
N4	N5	C1	90.0°	122.9°
CA	N5	C1	90.0°	127.8°
N5	C1	C13	90.0°	115.2°
N5	C1	O1	90.0°	101.1°
N5	C1	H18	90.0°	108.8°
C1	C13	C14	90.0°	111.7°
C13	C1	O1	90.0°	113.7°
C1	C13	O3	90.0°	108.6°
C13	C1	H18	90.0°	108.6°
C1	C13	H19	90.0°	109.5°
C13	C14	C15	90.0°	113.2°
C14	C13	O3	90.0°	109.6°
C13	C14	O2	90.0°	107.3°
C14	C13	H19	90.0°	108.5°
C13	C14	H25	90.0°	108.1°
C14	C15	C16	90.0°	111.2°
C15	C14	O2	90.0°	111.0°
C14	C15	O4	90.0°	108.8°
C15	C14	H25	90.0°	108.6°
C14	C15	H26	90.0°	108.5°
C15	C16	O1	90.0°	111.5°
C16	C15	O4	90.0°	112.5°
C15	C16	O5	90.0°	112.4°
C16	C15	H26	90.0°	107.4°
C15	C16	H27	90.0°	109.4°
C16	O1	C1	90.0°	115.7°
O1	C16	O5	90.0°	106.1°
O1	C16	H27	90.0°	109.7°
O1	C1	H18	90.0°	109.1°
O3	C13	H19	90.0°	108.9°
C13	O3	H28	90.0°	110.2°
O2	C14	H25	90.0°	108.4°
C14	O2	H29	90.0°	111.5°
O4	C15	H26	90.0°	108.3°
C15	O4	H30	90.0°	111.7°
O5	C16	H27	90.0°	107.6°
C16	O5	H31	90.0°	111.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C12	C11	PT	H1	109.9°	118.7°
C12	C11	PT	H2	109.8°	119.2°
C11	C12	PT	H3	114.3°	118.7°
C11	C12	PT	H4	114.3°	119.1°
C12	C11	PT	N1	0.2°	20.2°
C12	C11	PT	N10	172.7°	178.9°
C12	C11	PT	N3	88.7°	91.9°
C12	C11	H1	H2	143.9°	179.2°
C11	C12	H3	H4	134.5°	179.2°
C11	PT	N1	N10	172.6°	161.3°
C11	PT	N1	N3	89.8°	109.3°
C11	PT	N10	N3	94.9°	87.2°
C11	PT	N1	C2	11.3°	18.4°
C11	PT	N1	C1A	178.5°	174.5°
C11	PT	N10	C10	178.7°	175.1°
C11	PT	N10	C9	5.3°	7.9°
C11	PT	N3	C42	5.3°	146.2°
C11	PT	N3	C22	142.6°	71.6°
PT	C11	H1	H2	143.9°	107.5°
C12	PT	N1	N10	172.8°	175.8°
C12	PT	N1	N3	90.0°	94.8°
C12	PT	N10	N3	88.1°	89.3°
C12	PT	N1	C2	11.1°	3.9°
C12	PT	N1	C1A	178.6°	171.0°
C12	PT	N10	C10	174.5°	177.2°
C12	PT	N10	C9	1.5°	9.9°
C12	PT	N3	C42	44.6°	106.0°
C12	PT	N3	C22	103.3°	111.8°
PT	C12	H3	H4	134.5°	108.3°
N1	PT	N10	N3	83.4°	101.2°
PT	N1	C1A	C4A	174.8°	168.4°
PT	N1	C2	C3	172.2°	164.9°
PT	N1	C2	C1A	168.4°	166.1°
PT	N1	C2	C2A	9.9°	13.9°
PT	N1	C1A	C10	7.8°	11.0°
N1	PT	N10	C10	2.9°	13.3°
N1	PT	N10	C9	173.1°	179.5°
N1	PT	N3	C42	172.5°	11.5°
N1	PT	N3	C22	24.6°	130.7°
N1	PT	C11	H1	109.7°	138.9°
N1	PT	C11	H2	110.0°	99.0°
N1	PT	C12	H3	65.8°	52.4°
N1	PT	C12	H4	65.6°	69.8°
PT	N10	C10	C6A	174.6°	168.3°
N10	PT	N1	C2	176.1°	179.7°
N10	PT	N1	C1A	5.8°	13.2°
PT	N10	C10	C1A	0.6°	11.3°
PT	N10	C10	C9	177.9°	169.1°
PT	N10	C9	C8	176.3°	165.4°
PT	N10	C9	C9A	0.3°	14.1°
N10	PT	N3	C42	93.0°	95.1°
N10	PT	N3	C22	119.1°	47.1°
N10	PT	C11	H1	62.8°	62.4°
N10	PT	C11	H2	77.4°	59.7°
N10	PT	C12	H3	125.0°	115.9°
N10	PT	C12	H4	103.6°	121.9°
N3	PT	N1	C2	101.1°	90.9°
N3	PT	N1	C1A	88.7°	76.3°
N3	PT	N10	C10	86.3°	87.9°
N3	PT	N10	C9	89.7°	79.3°
PT	N3	C22	N12	152.8°	140.8°
PT	N3	C42	C52	151.2°	152.2°
PT	N3	C42	C22	150.2°	155.1°
N3	PT	C11	H1	21.2°	26.8°
N3	PT	C11	H2	161.5°	149.0°
N3	PT	C12	H3	150.9°	154.6°
N3	PT	C12	H4	19.5°	32.3°
PT	N3	C42	H23	28.8°	25.6°
PT	N3	C22	H24	27.2°	37.8°
C6A	C7	C8	H5	180.0°	179.9°
C7	C6A	C6	C10	179.4°	179.9°
C7	C6A	C6	C5	179.1°	180.0°
C7	C6A	C10	C1A	178.7°	179.9°
C7	C6A	C10	N10	3.7°	0.5°
C6A	C7	C8	C9	0.2°	0.2°
C7	C6A	C6	H6	0.9°	0.1°
C6A	C7	C8	H10	179.8°	179.9°
C8	C7	C6A	C6	179.2°	180.0°
C8	C7	C6A	C10	0.2°	0.1°
C7	C8	C9	N10	4.3°	0.7°
C7	C8	C9	H10	180.0°	179.7°
C7	C8	C9	C9A	179.2°	179.9°
C6A	C6	C5	H6	180.0°	179.9°
C6A	C6	C5	C4A	0.9°	0.0°
C6	C6A	C10	C1A	2.0°	0.0°
C6	C6A	C10	N10	177.0°	179.6°
C6	C6A	C7	H5	0.9°	0.0°
C6A	C6	C5	H7	179.1°	179.9°
C10	C6A	C6	C5	1.6°	0.1°
C6A	C10	C1A	C4A	1.8°	0.2°
C6A	C10	C1A	N1	179.1°	179.6°
C6A	C10	C1A	N10	174.3°	179.6°
C6A	C10	N10	C9	7.5°	0.9°
C10	C6A	C7	H5	179.7°	180.0°
C10	C6A	C6	H6	178.4°	179.8°
C6	C5	C4A	H7	180.0°	179.9°
C6	C5	C4A	C4	179.2°	180.0°
C6	C5	C4A	C1A	0.9°	0.2°
C5	C4A	C4	C1A	179.9°	179.8°
C5	C4A	C4	C3	179.7°	179.9°
C5	C4A	C1A	N1	178.9°	179.7°
C5	C4A	C1A	C10	1.4°	0.3°
C4A	C5	C6	H6	179.1°	179.9°
C5	C4A	C4	H8	0.2°	0.1°
C4A	C4	C3	H8	180.0°	179.7°
C4A	C4	C3	C2	0.3°	0.6°
C4	C4A	C1A	N1	1.2°	0.5°
C4	C4A	C1A	C10	178.7°	179.9°
C4	C4A	C5	H7	0.8°	0.1°
C4A	C4	C3	H9	179.7°	179.9°
C1A	C4A	C4	C3	0.2°	0.3°
C4A	C1A	N1	C2	3.1°	0.9°
C4A	C1A	N1	C10	177.4°	179.4°
C4A	C1A	C10	N10	176.1°	179.5°
C1A	C4A	C5	H7	179.1°	179.7°
C1A	C4A	C4	H8	179.9°	180.0°
C4	C3	C2	H9	180.0°	179.3°
C4	C3	C2	N1	2.1°	1.1°
C4	C3	C2	C2A	180.0°	179.9°
C3	C2	N1	C2A	177.9°	178.8°
C3	C2	N1	C1A	3.8°	1.2°
C2	C3	C4	H8	179.7°	179.7°
C3	C2	C2A	H11	180.0°	143.6°
C3	C2	C2A	H12	60.0°	24.3°
C3	C2	C2A	H13	60.0°	95.9°
C2	N1	C1A	C10	179.4°	179.6°
N1	C2	C3	H9	177.9°	179.6°
N1	C2	C2A	H11	2.0°	37.5°
N1	C2	C2A	H12	118.0°	156.8°
N1	C2	C2A	H13	122.0°	83.0°
C2A	C2	N1	C1A	178.3°	180.0°
C2A	C2	C3	H9	0.0°	0.8°
C2	C2A	H11	H12	120.0°	120.3°
C2	C2A	H11	H13	120.0°	120.5°
C2	C2A	H12	H13	120.0°	120.5°
N1	C1A	C10	N10	6.7°	0.0°
C1A	C10	N10	C9	178.5°	179.5°
C10	N10	C9	C8	8.1°	1.0°
C10	N10	C9	C9A	175.9°	179.6°
N10	C9	C8	C9A	176.5°	179.5°
N10	C9	C8	H10	175.7°	179.6°
N10	C9	C9A	H14	180.0°	158.2°
N10	C9	C9A	H15	60.0°	39.1°
N10	C9	C9A	H16	60.0°	81.5°
C9	C8	C7	H5	179.8°	179.9°
C8	C9	C9A	H14	3.5°	22.3°
C8	C9	C9A	H15	123.5°	141.4°
C8	C9	C9A	H16	116.5°	98.0°
C9A	C9	C8	H10	0.8°	0.2°
C9	C9A	H14	H15	120.0°	119.9°
C9	C9A	H14	H16	120.0°	120.6°
C9	C9A	H15	H16	120.0°	120.6°
CA	CB	C52	N2	22.3°	177.1°
CA	CB	C52	N12	54.1°	172.3°
CA	CB	C52	C42	132.9°	6.4°
CB	CA	H17	N5	180.0°	180.0°
CA	CB	N2	N4	90.0°	1.2°
CB	CA	N5	N4	90.0°	1.3°
CB	CA	N5	C1	90.0°	178.8°
CB	C52	N12	CM1	5.8°	0.7°
CB	C52	N12	C42	173.9°	178.9°
CB	C52	N12	C22	176.3°	178.2°
CB	C52	C42	N3	176.8°	176.8°
C52	CB	CA	H17	159.3°	0.9°
CB	C52	C42	H23	3.1°	0.9°
C52	CB	N2	N4	90.0°	178.7°
C52	CB	CA	N5	20.7°	179.1°
CM1	N12	C52	C22	177.9°	178.9°
CM1	N12	C52	C42	179.6°	179.6°
CM1	N12	C22	N3	180.0°	177.8°
N12	CM1	H20	H21	120.0°	120.0°
N12	CM1	H20	H22	120.0°	120.1°
N12	CM1	H21	H22	120.0°	120.1°
CM1	N12	C22	H24	0.0°	0.9°
N12	C52	C42	N3	2.1°	2.3°
C52	N12	C22	N3	1.9°	1.2°
C52	N12	CM1	H20	180.0°	150.2°
C52	N12	CM1	H21	60.0°	30.2°
C52	N12	CM1	H22	60.0°	89.8°
N12	C52	C42	H23	177.9°	180.0°
C52	N12	C22	H24	178.1°	179.8°
N12	C52	CB	N2	31.8°	4.8°
C22	N12	C52	C42	2.4°	0.7°
N12	C22	N3	C42	0.5°	2.5°
N12	C22	N3	H24	180.0°	178.6°
C22	N12	CM1	H20	2.3°	31.1°
C22	N12	CM1	H21	122.3°	151.1°
C22	N12	CM1	H22	117.8°	88.9°
C52	C42	N3	H23	180.0°	177.8°
C52	C42	N3	C22	1.0°	3.0°
C42	C52	CB	N2	155.2°	176.4°
C42	N3	C22	H24	179.5°	178.9°
C22	N3	C42	H23	179.0°	179.3°
H1	C11	C12	H3	135.8°	178.3°
H1	C11	C12	H4	4.4°	0.9°
H2	C11	C12	H3	4.4°	0.9°
H2	C11	C12	H4	135.8°	179.9°
H5	C7	C8	H10	0.3°	0.2°
H6	C6	C5	H7	0.9°	0.0°
H8	C4	C3	H9	0.3°	0.4°
H11	C2A	H12	H13	120.0°	119.5°
H14	C9A	H15	H16	120.0°	119.3°
H17	CA	CB	N2	180.0°	178.5°
H17	CA	N5	N4	90.0°	178.7°
H17	CA	N5	C1	90.0°	1.2°
H20	CM1	H21	H22	120.0°	119.9°
CB	N2	N4	N5	90.0°	0.4°
N2	CB	CA	N5	NaN°	1.5°
N2	N4	N5	CA	90.0°	0.6°
N2	N4	N5	C1	90.0°	178.2°
N4	N5	CA	C1	90.0°	177.5°
N4	N5	C1	C13	90.0°	140.5°
N4	N5	C1	O1	90.0°	96.5°
N4	N5	C1	H18	90.0°	18.2°
CA	N5	C1	C13	90.0°	42.3°
CA	N5	C1	O1	90.0°	80.7°
CA	N5	C1	H18	90.0°	164.6°
N5	C1	C13	O1	90.0°	116.0°
N5	C1	C13	H18	90.0°	122.4°
N5	C1	C13	C14	90.0°	162.8°
N5	C1	O1	C16	90.0°	176.8°
N5	C1	O1	H18	90.0°	114.5°
N5	C1	C13	O3	90.0°	76.2°
N5	C1	C13	H19	90.0°	42.6°
C1	C13	C14	O3	90.0°	120.4°
C1	C13	C14	H19	90.0°	120.8°
C1	C13	C14	C15	90.0°	46.4°
C13	C1	O1	C16	90.0°	52.7°
C13	C1	O1	H18	90.0°	121.4°
C1	C13	O3	H19	90.0°	119.1°
C1	C13	C14	O2	90.0°	169.3°
C1	C13	C14	H25	90.0°	73.9°
C1	C13	O3	H28	90.0°	65.6°
C13	C14	C15	O2	90.0°	120.8°
C13	C14	C15	H25	90.0°	120.0°
C13	C14	C15	C16	90.0°	49.6°
C14	C13	C1	O1	90.0°	46.8°
C14	C13	O3	H19	90.0°	118.6°
C13	C14	O2	H25	90.0°	116.5°
C13	C14	C15	O4	90.0°	174.1°
C14	C13	C1	H18	90.0°	74.9°
C13	C14	C15	H26	90.0°	68.2°
C14	C13	O3	H28	90.0°	172.1°
C13	C14	O2	H29	90.0°	172.5°
C14	C15	C16	O4	90.0°	122.3°
C14	C15	C16	H26	90.0°	118.6°
C14	C15	C16	O1	90.0°	52.6°
C15	C14	C13	O3	90.0°	166.8°
C15	C14	O2	H25	90.0°	119.3°
C14	C15	O4	H26	90.0°	117.8°
C14	C15	C16	O5	90.0°	171.6°
C15	C14	C13	H19	90.0°	74.3°
C14	C15	C16	H27	90.0°	68.9°
C15	C14	O2	H29	90.0°	63.3°
C14	C15	O4	H30	90.0°	172.2°
C15	C16	O1	O5	90.0°	122.7°
C15	C16	O1	H27	90.0°	121.3°
C15	C16	O1	C1	90.0°	55.2°
C16	C15	C14	O2	90.0°	170.4°
C16	C15	O4	H26	90.0°	118.5°
C15	C16	O5	H27	90.0°	120.5°
C16	C15	C14	H25	90.0°	70.4°
C16	C15	O4	H30	90.0°	64.1°
C15	C16	O5	H31	90.0°	65.6°
O1	C16	C15	O4	90.0°	174.9°
O1	C16	O5	H27	90.0°	117.4°
C16	O1	C1	H18	90.0°	68.7°
O1	C16	C15	H26	90.0°	66.0°
O1	C16	O5	H31	90.0°	172.3°
O1	C1	C13	O3	90.0°	167.8°
C1	O1	C16	O5	90.0°	177.9°
O1	C1	C13	H19	90.0°	73.4°
C1	O1	C16	H27	90.0°	66.1°
O3	C13	C14	O2	90.0°	70.3°
O3	C13	C1	H18	90.0°	46.2°
O3	C13	C14	H25	90.0°	46.5°
O2	C14	C15	O4	90.0°	65.1°
O2	C14	C13	H19	90.0°	48.5°
O2	C14	C15	H26	90.0°	52.6°
O4	C15	C16	O5	90.0°	66.0°
O4	C15	C14	H25	90.0°	54.0°
O4	C15	C16	H27	90.0°	53.5°
O5	C16	C15	H26	90.0°	53.0°
H18	C1	C13	H19	90.0°	165.0°
H19	C13	C14	H25	90.0°	165.3°
H19	C13	O3	H28	90.0°	53.5°
H25	C14	C15	H26	90.0°	171.7°
H25	C14	O2	H29	90.0°	56.0°
H26	C15	C16	H27	90.0°	172.5°
H26	C15	O4	H30	90.0°	54.4°
H27	C16	O5	H31	90.0°	54.9°

Release date:	2018-04-25
Definition date:	2018-02-02
Last modified:	2026-09-16
Release status:	REL
Processing site:	RCSB
Derived from:	6F60