# --------------------------------------------------------------------------
#
# CIF file generated by openbabel 2.3.2 http://openbabel.org/
# to comply with the Macromolecular CIF Dictionary  (cif_mm.dic) version  2.0.11 http://mmcif.pdb.org/
# The contents of this file were derived from PLPI2A.gro
#
#---------------------------------------------------------------------------

data_PLPI2A

###########
## ENTRY ##
###########

_entry.id	PLPI2A

##############
## CHEMICAL ##
##############

_chemical.entry_id	PLPI2A
_chemical.name_common	'PLPI2A'

######################
## CHEMICAL FORMULA ##
######################

_chemical_formula.entry_id	PLPI2A
_chemical_formula.structural	'C43H81O19P3'

###############
## ATOM_SITE ##
###############

loop_
_atom_site.id
_atom_site.type_symbol
_atom_site.label_atom_id
_atom_site.label_comp_id
_atom_site.label_entity_id
_atom_site.label_seq_id
_atom_site.Cartn_x
_atom_site.Cartn_y
_atom_site.Cartn_z
	1	C	C12	PLPI2A	1	1
	19.91	13.83	62.38
	2	H	H2	PLPI2A	1	1
	20.81	14.05	61.78
	3	O	O2	PLPI2A	1	1
	19.83	12.38	62.38
	4	H	HO2	PLPI2A	1	1
	20	12.09	61.49
	5	C	C13	PLPI2A	1	1
	20.05	14.46	63.82
	6	H	H3	PLPI2A	1	1
	19.87	15.37	63.24
	7	O	O3	PLPI2A	1	1
	21.13	15.1	64.52
	8	P	P3	PLPI2A	1	1
	20.88	16.68	65.12
	9	O	OP32	PLPI2A	1	1
	22.31	16.98	64.58
	10	H	HP32	PLPI2A	1	1
	22.79	16.21	64.94
	11	O	OP33	PLPI2A	1	1
	19.89	17.58	64.39
	12	O	OP34	PLPI2A	1	1
	20.85	16.71	66.64
	13	C	C14	PLPI2A	1	1
	18.83	14.03	64.68
	14	H	H4	PLPI2A	1	1
	18.86	12.94	64.68
	15	O	O4	PLPI2A	1	1
	18.95	14.44	66.05
	16	H	HO4	PLPI2A	1	1
	19.79	14.06	66.33
	17	C	C15	PLPI2A	1	1
	17.56	14.58	64.1
	18	H	H5	PLPI2A	1	1
	17.59	15.7	64.18
	19	O	O5	PLPI2A	1	1
	16.42	13.97	64.83
	20	P	P5	PLPI2A	1	1
	16.29	12.45	65.61
	21	O	OP52	PLPI2A	1	1
	16.57	12.68	67.11
	22	O	OP53	PLPI2A	1	1
	14.85	11.96	65.44
	23	O	OP54	PLPI2A	1	1
	17.26	11.46	64.98
	24	C	C16	PLPI2A	1	1
	17.42	14.16	62.63
	25	H	H6	PLPI2A	1	1
	17.21	13.09	62.55
	26	O	O6	PLPI2A	1	1
	16.3	14.87	62.09
	27	H	HO6	PLPI2A	1	1
	15.58	14.25	62.19
	28	C	C11	PLPI2A	1	1
	18.64	14.51	61.75
	29	H	H1	PLPI2A	1	1
	18.77	15.63	61.76
	30	P	P	PLPI2A	1	1
	19.13	14.96	59.13
	31	O	O13	PLPI2A	1	1
	20.6	14.9	59.18
	32	O	O14	PLPI2A	1	1
	18.48	16.28	58.98
	33	O	O12	PLPI2A	1	1
	18.5	14.1	60.4
	34	O	O11	PLPI2A	1	1
	18.64	14	57.95
	35	C	C1	PLPI2A	1	1
	19.07	12.64	58.06
	36	H	HA	PLPI2A	1	1
	18.75	12.19	59.03
	37	H	HB	PLPI2A	1	1
	20.18	12.58	57.99
	38	C	C2	PLPI2A	1	1
	18.43	11.72	56.98
	39	H	HS	PLPI2A	1	1
	19.12	10.86	56.83
	40	O	O21	PLPI2A	1	1
	18.27	12.44	55.76
	41	C	C21	PLPI2A	1	1
	17.72	11.83	54.74
	42	O	O22	PLPI2A	1	1
	17.38	10.67	54.66
	43	C	C22	PLPI2A	1	1
	17.65	12.82	53.6
	44	H	H2R	PLPI2A	1	1
	16.87	13.58	53.8
	45	H	H2S	PLPI2A	1	1
	17.34	12.25	52.71
	46	C	C3	PLPI2A	1	1
	17.07	11.17	57.49
	47	H	HX	PLPI2A	1	1
	16.73	10.33	56.86
	48	H	HY	PLPI2A	1	1
	17.21	10.76	58.52
	49	O	O31	PLPI2A	1	1
	16.12	12.2	57.44
	50	C	C31	PLPI2A	1	1
	15.49	12.53	58.55
	51	O	O32	PLPI2A	1	1
	15.45	11.89	59.58
	52	C	C32	PLPI2A	1	1
	14.61	13.66	58.25
	53	H	H2X	PLPI2A	1	1
	15.07	14.66	58.32
	54	H	H2Y	PLPI2A	1	1
	13.77	13.62	58.95
	55	C	C23	PLPI2A	1	1
	19.01	13.49	53.39
	56	H	H3R	PLPI2A	1	1
	19.73	12.77	52.95
	57	H	H3S	PLPI2A	1	1
	19.46	13.86	54.35
	58	C	C24	PLPI2A	1	1
	18.78	14.7	52.51
	59	H	H4R	PLPI2A	1	1
	19.6	15.36	52.52
	60	H	H4S	PLPI2A	1	1
	18.01	15.32	52.99
	61	C	C25	PLPI2A	1	1
	18.44	14.35	51.06
	62	H	H5R	PLPI2A	1	1
	17.66	15.03	50.69
	63	H	H5S	PLPI2A	1	1
	18.11	13.29	51.02
	64	C	C26	PLPI2A	1	1
	19.63	14.45	50.13
	65	H	H6R	PLPI2A	1	1
	20.35	13.72	50.59
	66	H	H6S	PLPI2A	1	1
	20.04	15.49	50.16
	67	C	C27	PLPI2A	1	1
	19.43	14.01	48.68
	68	H	H7R	PLPI2A	1	1
	18.62	13.26	48.65
	69	H	H7S	PLPI2A	1	1
	20.36	13.52	48.29
	70	C	C28	PLPI2A	1	1
	19.04	15.15	47.73
	71	H	H8R	PLPI2A	1	1
	18.14	15.65	48.13
	72	H	H8S	PLPI2A	1	1
	18.75	14.65	46.79
	73	C	C29	PLPI2A	1	1
	20.12	16.17	47.47
	74	H	H91	PLPI2A	1	1
	20.79	16.35	48.32
	75	C	C210	PLPI2A	1	1
	20.39	16.79	46.31
	76	H	H101	PLPI2A	1	1
	21.21	17.51	46.28
	77	C	C211	PLPI2A	1	1
	19.68	16.64	45
	78	H	H11R	PLPI2A	1	1
	19.65	17.63	44.49
	79	H	H11S	PLPI2A	1	1
	18.62	16.35	45.17
	80	C	C212	PLPI2A	1	1
	20.42	15.65	44.13
	81	H	H121	PLPI2A	1	1
	21.38	16.02	43.76
	82	C	C213	PLPI2A	1	1
	20.03	14.45	43.69
	83	H	H131	PLPI2A	1	1
	20.7	13.88	43.03
	84	C	C214	PLPI2A	1	1
	18.72	13.77	43.99
	85	H	H14R	PLPI2A	1	1
	17.96	13.99	43.21
	86	H	H14S	PLPI2A	1	1
	18.3	14.16	44.94
	87	C	C215	PLPI2A	1	1
	18.89	12.24	44.17
	88	H	H15R	PLPI2A	1	1
	18.04	11.87	44.77
	89	H	H15S	PLPI2A	1	1
	19.81	12.05	44.77
	90	C	C216	PLPI2A	1	1
	18.96	11.38	42.89
	91	H	H16R	PLPI2A	1	1
	19.05	10.32	43.24
	92	H	H16S	PLPI2A	1	1
	19.88	11.61	42.31
	93	C	C217	PLPI2A	1	1
	17.76	11.47	41.92
	94	H	H17R	PLPI2A	1	1
	17.97	10.86	41.01
	95	H	H17S	PLPI2A	1	1
	17.66	12.52	41.59
	96	C	C218	PLPI2A	1	1
	16.42	10.99	42.48
	97	H	H18R	PLPI2A	1	1
	16.45	9.91	42.72
	98	H	H18S	PLPI2A	1	1
	16.16	11.54	43.41
	99	H	H18T	PLPI2A	1	1
	15.62	11.13	41.72
	100	C	C33	PLPI2A	1	1
	14.11	13.37	56.84
	101	H	H3X	PLPI2A	1	1
	13.08	13.46	57.06
	102	H	H3Y	PLPI2A	1	1
	13.86	12.34	56.55
	103	C	C34	PLPI2A	1	1
	14.66	14.29	55.72
	104	H	H4X	PLPI2A	1	1
	15.73	14.05	55.65
	105	H	H4Y	PLPI2A	1	1
	14.45	15.37	55.91
	106	C	C35	PLPI2A	1	1
	14.34	14.06	54.25
	107	H	H5X	PLPI2A	1	1
	13.72	13.18	54.27
	108	H	H5Y	PLPI2A	1	1
	14.78	13.23	53.71
	109	C	C36	PLPI2A	1	1
	13.93	15.38	53.43
	110	H	H6X	PLPI2A	1	1
	14.93	15.8	53.31
	111	H	H6Y	PLPI2A	1	1
	13.21	16.03	53.98
	112	C	C37	PLPI2A	1	1
	13.34	15.22	52
	113	H	H7X	PLPI2A	1	1
	13.02	16.1	51.43
	114	H	H7Y	PLPI2A	1	1
	12.26	14.94	51.86
	115	C	C38	PLPI2A	1	1
	14.18	14.13	51.4
	116	H	H8X	PLPI2A	1	1
	14.01	13.15	51.93
	117	H	H8Y	PLPI2A	1	1
	15.26	14.06	51.57
	118	C	C39	PLPI2A	1	1
	13.8	14.02	49.96
	119	H	H9X	PLPI2A	1	1
	12.72	13.9	49.63
	120	H	H9Y	PLPI2A	1	1
	14.42	13.1	49.92
	121	C	C310	PLPI2A	1	1
	14.28	15	49.02
	122	H	H10X	PLPI2A	1	1
	15.31	15.1	49.39
	123	H	H10Y	PLPI2A	1	1
	13.61	15.86	49.22
	124	C	C311	PLPI2A	1	1
	14.23	14.52	47.58
	125	H	H11X	PLPI2A	1	1
	13.18	14.35	47.24
	126	H	H11Y	PLPI2A	1	1
	14.78	13.55	47.49
	127	C	C312	PLPI2A	1	1
	14.93	15.54	46.72
	128	H	H12X	PLPI2A	1	1
	16.01	15.58	47.02
	129	H	H12Y	PLPI2A	1	1
	14.49	16.54	46.92
	130	C	C313	PLPI2A	1	1
	14.79	15.24	45.24
	131	H	H13X	PLPI2A	1	1
	13.7	15.17	45.01
	132	H	H13Y	PLPI2A	1	1
	15.25	14.25	44.98
	133	C	C314	PLPI2A	1	1
	15.39	16.35	44.38
	134	H	H14X	PLPI2A	1	1
	16.44	16.56	44.67
	135	H	H14Y	PLPI2A	1	1
	14.8	17.28	44.55
	136	C	C315	PLPI2A	1	1
	15.39	16	42.89
	137	H	H15X	PLPI2A	1	1
	16.1	15.15	42.74
	138	H	H15Y	PLPI2A	1	1
	15.78	16.88	42.35
	139	C	C316	PLPI2A	1	1
	14.04	15.58	42.29
	140	H	H16X	PLPI2A	1	1
	13.88	14.49	42.44
	141	H	H16Y	PLPI2A	1	1
	13.2	16.13	42.75
	142	H	H16Z	PLPI2A	1	1
	14.04	15.78	41.2

##########
## CELL ##
##########

_cell.entry_id	PLPI2A
_cell.length_a	50
_cell.length_b	50
_cell.length_c	50
_cell.angle_alpha	90
_cell.angle_beta	90
_cell.angle_gamma	90

