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Receptor

PDB id	Resolution	Class	Description	Source	Keywords
4YKP	1.46 Å	NON-ENZYME: BINDING	MNEMIOPSIS LEIDYI ML032222A IGLUR LBD SERINE COMPLEX	MNEMIOPSIS LEIDYI	MEMBRANE PROTEIN GLUTAMATE RECEPTOR ION CHANNEL
Ref.:	GLYCINE ACTIVATED ION CHANNEL SUBUNITS ENCODED BY C GLUTAMATE RECEPTOR GENES. PROC.NATL.ACAD.SCI.USA V. 112 E6048 2015

Ligand

Ligand	Chain:Residue	Validity	Ligand Warnings	Binding Data	Molecular Weight (Da)	Formula	SMILES
SER	B:302; A:302;	Valid; Valid;	none; none;	submit data	105.093	C3 H7 N O3	C([C@...
GLY	A:301; B:301;	Valid; Valid;	none; none;	submit data	75.067	C2 H5 N O2	C(C(=...
MG	A:303;	Part of Protein;	none;	submit data	24.305	Mg	[Mg+2...

View in 3D viewer

90% Homology Family

Leader

PDB id	Resolution	Class	Description	Source	Keywords
4YKI	1.21 Å	NON-ENZYME: BINDING	MNEMIOPSIS LEIDYI ML032222A IGLUR LBD GLYCINE COMPLEX	MNEMIOPSIS LEIDYI	MEMBRANE PROTEIN GLUTAMATE RECEPTOR ION CHANNEL
Ref.:	GLYCINE ACTIVATED ION CHANNEL SUBUNITS ENCODED BY C GLUTAMATE RECEPTOR GENES. PROC.NATL.ACAD.SCI.USA V. 112 E6048 2015

Members (6)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 552 families.
1	4YKK	Ki = 1.7 mM	DSN	C3 H7 N O3	C([C@H](C(....
2	5CMC	Kd = 2.48 uM	GLY	C2 H5 N O2	C(C(=O)O)N
3	5CMB	Kd = 28.3 nM	GLY	C2 H5 N O2	C(C(=O)O)N
4	4YKJ	Ki = 37 uM	ALA	C3 H7 N O2	C[C@@H](C(....
5	4YKI	Kd = 2.7 nM	GLY	C2 H5 N O2	C(C(=O)O)N
6	4YKP	-	GLY	C2 H5 N O2	C(C(=O)O)N

70% Homology Family (6)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 426 families.
1	4YKK	Ki = 1.7 mM	DSN	C3 H7 N O3	C([C@H](C(....
2	5CMC	Kd = 2.48 uM	GLY	C2 H5 N O2	C(C(=O)O)N
3	5CMB	Kd = 28.3 nM	GLY	C2 H5 N O2	C(C(=O)O)N
4	4YKJ	Ki = 37 uM	ALA	C3 H7 N O2	C[C@@H](C(....
5	4YKI	Kd = 2.7 nM	GLY	C2 H5 N O2	C(C(=O)O)N
6	4YKP	-	GLY	C2 H5 N O2	C(C(=O)O)N

50% Homology Family (264)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 181 families.
1	4O3B	Ki = 0.82 uM	GLU	C5 H9 N O4	C(CC(=O)O)....
2	5CBS	Kd = 3.9 uM	E42	C15 H15 N O3	c1cc(cc(c1....
3	3PD8	Ki = 108 nM	HA7	C7 H8 N2 O4	C1CN[C@@H]....
4	1P1O	Kd = 1.74 uM	QUS	C5 H7 N3 O5	C([C@@H](C....
5	1MQH	ic50 = 0.3 uM	BWD	C7 H8 Br N3 O4	C1=C(C(=O)....
6	1FTK	ic50 = 14.5 uM	KAI	C10 H15 N O4	CC(=C)[C@H....
7	3TKD	-	CYZ	C14 H16 Cl N3 O4 S2	c1c2c(cc(c....
8	1M5F	ic50 = 14.8 nM	AM1	C8 H10 N2 O5	Cc1c(c(no1....
9	5FTI	-	GLU	C5 H9 N O4	C(CC(=O)O)....
10	1XHY	Ki = 624 nM	KAI	C10 H15 N O4	CC(=C)[C@H....
11	1M5C	ic50 = 0.5 uM	BRH	C6 H7 Br N2 O4	C(c1c(c(no....
12	1SYI	Ki = 3330 nM	CPW	C10 H13 N3 O4	C1CC2=C(C1....
13	5O9A	-	7M6	C9 H10 Cl F N2 O2 S	c1cc2c(cc1....
14	1MY3	-	BWD	C7 H8 Br N3 O4	C1=C(C(=O)....
15	3ILU	-	HFZ	C8 H8 F3 N3 O4 S2	c1c(c(cc2c....
16	3PMV	-	557	C17 H22 F3 N3 O3 S	C[C@H](CNS....
17	5H8S	-	5YC	C15 H16 N4 O S	CCN(CC1=CC....
18	6HC9	-	FXW	C22 H26 N4 O4 S2	c1cc2c(cc1....
19	6YK3	Ki = 17.5 uM	PVQ	C9 H12 N4 O4	C1C2=C(CN1....
20	2XHD	-	GLU	C5 H9 N O4	C(CC(=O)O)....
21	3B7D	-	CNI	C9 H2 N4 O4	C1=C(C(=CC....
22	4U1Z	-	KAI	C10 H15 N O4	CC(=C)[C@H....
23	1WVJ	Ki = 185 nM	IBC	C11 H14 N2 O4	C1CC=C(c2c....
24	1P1U	-	AMQ	C7 H10 N2 O4	Cc1c(c(no1....
25	4Q30	-	NWD	C7 H8 N4 O6	C1=C(C(=O)....
26	6YK2	Ki = 0.762 uM	CGW	C9 H11 N3 O4 S	C1C2=C(CS1....
27	4U23	-	FWD	C7 H8 F N3 O4	C1=C(C(=O)....
28	6Q60	-	HJH	C6 H10 N4 O3	Cn1nc(c(n1....
29	1MQG	ic50 = 0.52 uM	IWD	C7 H8 I N3 O4	C1=C(C(=O)....
30	3BBR	-	BHY	C20 H28 N2 O4 S2	C[C@@H](CN....
31	3LSF	-	PZI	C6 H10 N2 O2	C1CC(=O)N(....
32	3PMX	-	808	C18 H20 F3 N O3 S	CC(C)S(=O)....
33	2ANJ	-	KAI	C10 H15 N O4	CC(=C)[C@H....
34	2XX8	-	1NE	C17 H18 F3 N3 O	CN(C)C(=O)....
35	1P1Q	Kd = 12.8 uM	AMQ	C7 H10 N2 O4	Cc1c(c(no1....
36	2AL5	-	FWD	C7 H8 F N3 O4	C1=C(C(=O)....
37	5YBG	ic50 = 0.03 uM	8SO	C21 H30 N2 O4 S2	C[C@@H](CN....
38	1M5E	ic50 = 20.1 nM	AM1	C8 H10 N2 O5	Cc1c(c(no1....
39	3BKI	ic50 = 7.6 uM	FQX	C8 H4 N4 O4	c1c2c(cc3c....
40	2AIX	-	U1K	C10 H16 N2 O3 S	CC(C)(C)c1....
41	3B6W	-	GLU	C5 H9 N O4	C(CC(=O)O)....
42	2I3W	-	GLU	C5 H9 N O4	C(CC(=O)O)....
43	3O6H	-	O25	C18 H22 F3 N5 O2 S	CCNCc1cn(n....
44	6HCC	-	GLU	C5 H9 N O4	C(CC(=O)O)....
45	3KGC	-	ZK1	C14 H15 F3 N3 O6 P	c1c(c(cc2c....
46	3BFU	Ki = 531 nM	R2P	C5 H7 N3 O3 S	C(c1c(nsn1....
47	3UA8	ic50 = 14 nM	08W	C15 H13 F3 N6 O5 S	CNC(=O)c1c....
48	4LZ7	-	GLU	C5 H9 N O4	C(CC(=O)O)....
49	1FTL	ic50 = 998 nM	DNQ	C8 H2 N4 O6	C1=C(C(=CC....
50	3B6Q	-	GLU	C5 H9 N O4	C(CC(=O)O)....
51	3RN8	-	RN8	C22 H16 N2 O4 S2	CCc1c(c(c(....
52	1P1W	-	AMQ	C7 H10 N2 O4	Cc1c(c(no1....
53	1MQI	ic50 = 23.53 nM	FWD	C7 H8 F N3 O4	C1=C(C(=O)....
54	3O29	-	O29	C23 H30 F3 N5 O2 S	CN(C)CCNC(....
55	1FTJ	ic50 = 821 nM	GLU	C5 H9 N O4	C(CC(=O)O)....
56	3PD9	Ki = 494 nM	HA5	C7 H8 N2 O4	C1c2c(onc2....
57	1M5B	ic50 = 9.7 nM	BN1	C8 H10 N6 O4	Cn1nc(nn1)....
58	6HCA	-	FXW	C22 H26 N4 O4 S2	c1cc2c(cc1....
59	3EN3	-	KAI	C10 H15 N O4	CC(=C)[C@H....
60	1SYH	Ki = 393 nM	CPW	C10 H13 N3 O4	C1CC2=C(C1....
61	4X48	-	XPF	C18 H20 N2 O4 S2	CC(C)S(=O)....
62	3H6W	-	NS7	C19 H29 N3 O4 S2	Cc1cc2c(cc....
63	1MY4	-	IWD	C7 H8 I N3 O4	C1=C(C(=O)....
64	4IGT	Kd = 12.8 nM	3ZA	C9 H16 N2 O6	CN(C(=O)CC....
65	3M3L	-	P99	C16 H16 F2 N2 O4 S2	c1ccc(cc1)....
66	6GL4	-	GLU	C5 H9 N O4	C(CC(=O)O)....
67	5CBR	Kd = 1.8 uM	4ZK	C14 H12 Cl2 N2 O3	c1c(cc(c(c....
68	4GXS	-	0YS	C18 H21 Cl2 N3 O9	c1c(cc(c(c....
69	4U21	-	FWF	C24 H36 N2 O4 S2	C[C@@H](CN....
70	4YMA	-	4E5	C12 H13 N O5	c1c(cc(cc1....
71	1FW0	-	KAI	C10 H15 N O4	CC(=C)[C@H....
72	1LB8	-	AMQ	C7 H10 N2 O4	Cc1c(c(no1....
73	3FAS	Ki = 171 nM	GLU	C5 H9 N O4	C(CC(=O)O)....
74	4U22	-	FWD	C7 H8 F N3 O4	C1=C(C(=O)....
75	6FQJ	-	ZK1	C14 H15 F3 N3 O6 P	c1c(c(cc2c....
76	4ISU	Ki = 0.21 mM	IKM	C12 H14 N2 O6	C1C=C[C@H]....
77	1MXU	ic50 = 4 uM	BWD	C7 H8 Br N3 O4	C1=C(C(=O)....
78	4U4X	Kd = 9.8 uM	3C2	C8 H11 N3 O2 S	CCN1CNS(=O....
79	1MM7	ic50 = 20 nM	QUS	C5 H7 N3 O5	C([C@@H](C....
80	2XX9	-	1NF	C19 H19 F4 N3 O	c1cc(c(cc1....
81	3M3K	-	GLU	C5 H9 N O4	C(CC(=O)O)....
82	2XXH	-	1NG	C20 H22 F3 N3 O	c1cc(ccc1C....
83	5ZG3	Ki = 0.061 uM	9C6	C19 H16 N2 O3 S	c1ccc(cc1)....
84	5FHM	-	5XP	C15 H17 N7 O4	c1cc(cc(c1....
85	4N07	Kd = 0.35 uM	2J9	C10 H11 F N2 O2 S	c1cc2c(cc1....
86	3IJO	-	GLU	C5 H9 N O4	C(CC(=O)O)....
87	3RNN	-	RNN	C16 H28 N2 O4 S2	CC(C)S(=O)....
88	2AL4	-	QUS	C5 H7 N3 O5	C([C@@H](C....
89	4LZ5	-	GLU	C5 H9 N O4	C(CC(=O)O)....
90	4U4S	Kd = 1200 uM	3C1	C8 H11 N3 O2 S	CCN1CNS(=O....
91	4G8M	Kd = 12.8 nM	G8M	C7 H11 N O4	C1C[C@@H](....
92	3H6T	-	CYZ	C14 H16 Cl N3 O4 S2	c1c2c(cc(c....
93	3O6G	-	O27	C23 H28 F3 N5 O2 S	C1CCc2c(c(....
94	1NNP	-	CE2	C10 H15 N2 O4	CC(C)(C)c1....
95	5YBF	Kd = 543 nM	8SR	C16 H17 F3 N4 O2 S	Cc1cc(nn1C....
96	1P1N	Kd = 0.16 uM	KAI	C10 H15 N O4	CC(=C)[C@H....
97	1M5D	ic50 = 9.2 uM	BRH	C6 H7 Br N2 O4	C(c1c(c(no....
98	5ZG1	Ki = 0.019 uM	9C0	C17 H20 N2 O2 S	CC(C)(C)c1....
99	3IK6	-	GLU	C5 H9 N O4	C(CC(=O)O)....
100	2XXI	-	JAC	C18 H18 F3 N3 O2	c1cc(ccc1C....
101	4O3A	Ki = 2.57 mM	ASP	C4 H7 N O4	C([C@@H](C....
102	3B6T	-	QUS	C5 H7 N3 O5	C([C@@H](C....
103	6GIV	-	GLU	C5 H9 N O4	C(CC(=O)O)....
104	4FAT	-	GLU	C5 H9 N O4	C(CC(=O)O)....
105	3H6U	-	NS3	C18 H28 N4 O4 S2	Cc1cc2c(cc....
106	1NNK	ic50 = 3.5 uM	CE2	C10 H15 N2 O4	CC(C)(C)c1....
107	3FAT	Kd = 22.8 nM	AMQ	C7 H10 N2 O4	Cc1c(c(no1....
108	3T9X	-	GLU	C5 H9 N O4	C(CC(=O)O)....
109	1MY2	-	AMQ	C7 H10 N2 O4	Cc1c(c(no1....
110	3ILT	-	TRU	C8 H8 Cl3 N3 O4 S2	c1c2c(cc(c....
111	3O6I	-	O26	C20 H29 N5 O2 S	CC(C)(C)c1....
112	3DLN	-	GLU	C5 H9 N O4	C(CC(=O)O)....
113	3RTW	-	NWD	C7 H8 N4 O6	C1=C(C(=O)....
114	1MQD	ic50 = 0.17 uM	SHI	C6 H8 N2 O4	c1c(c(no1)....
115	3T93	-	GLU	C5 H9 N O4	C(CC(=O)O)....
116	6Q54	-	HJ8	C7 H12 N4 O3	CCn1c(c(nn....
117	6YK6	Ki = 135 uM	OUB	C9 H9 N3 O5	c1c2c(co1)....
118	6HCB	-	D45	C18 H22 N4 O4 S2	CN1CNS(=O)....
119	4F29	Ki = 0.168 uM	QUS	C5 H7 N3 O5	C([C@@H](C....
120	1MS7	ic50 = 0.17 uM	SHI	C6 H8 N2 O4	c1c(c(no1)....
121	3R7X	ic50 = 0.082 uM	QSN	C12 H10 N6 O6 S	CS(=O)(=O)....
122	3BFT	Ki = 323 nM	S2P	C5 H7 N3 O3 S	C(c1c(nsn1....
123	6FQH	-	E2Q	C12 H8 N4 O6 S	c1cc2c(c(c....
124	5JEI	-	FWD	C7 H8 F N3 O4	C1=C(C(=O)....
125	3O28	-	O28	C19 H21 F3 N4 O2 S	C1CCc2c(c(....
126	4IY6	-	MQS	C15 H17 N3 O	C[C@H]1CCC....
127	3LSL	-	PZI	C6 H10 N2 O2	C1CC(=O)N(....
128	2XX7	-	1ND	C19 H20 F3 N3 O	c1cc(ccc1C....
129	1FTM	Kd = 24.8 nM	AMQ	C7 H10 N2 O4	Cc1c(c(no1....
130	2GFE	-	GLU	C5 H9 N O4	C(CC(=O)O)....
131	4F31	Ki = 2.08 uM	KAI	C10 H15 N O4	CC(=C)[C@H....
132	5ZG2	-	ZK1	C14 H15 F3 N3 O6 P	c1c(c(cc2c....
133	3T9U	-	CNI	C9 H2 N4 O4	C1=C(C(=CC....
134	3T96	-	IWD	C7 H8 I N3 O4	C1=C(C(=O)....
135	3KFM	-	KAI	C10 H15 N O4	CC(=C)[C@H....
136	6YK5	Ki = 4.73 uM	PVK	C9 H11 N3 O5	C1C2=C(CO1....
137	2I3V	-	GLU	C5 H9 N O4	C(CC(=O)O)....
138	3T9H	-	KAI	C10 H15 N O4	CC(=C)[C@H....
139	3PMW	-	G69	C18 H22 F3 N3 O3 S	CC(C)S(=O)....
140	3H6V	-	NS6	C18 H27 N3 O4 S2	CN1CCN(CC1....
141	1LBB	-	KAI	C10 H15 N O4	CC(=C)[C@H....
142	5BUU	-	4V6	C10 H13 Cl N2 O2 S	C[C@@H]1N(....
143	3H03	ic50 = 135 uM	UBP	C10 H13 N3 O6	C1=CN(C(=O....
144	6FQK	-	ZK1	C14 H15 F3 N3 O6 P	c1c(c(cc2c....
145	1LB9	-	DNQ	C8 H2 N4 O6	C1=C(C(=CC....
146	1N0T	ic50 = 12.2 uM	AT1	C11 H19 N2 O7 P	CC(C)(C)c1....
147	5ZG0	Ki = 0.082 uM	9C3	C16 H18 N2 O3 S	CC(C)Oc1cc....
148	3T9V	-	CNI	C9 H2 N4 O4	C1=C(C(=CC....
149	1GR2	-	KAI	C10 H15 N O4	CC(=C)[C@H....
150	5OEW	-	GLU	C5 H9 N O4	C(CC(=O)O)....
151	3IL1	-	GLU	C5 H9 N O4	C(CC(=O)O)....
152	3DP6	-	GLU	C5 H9 N O4	C(CC(=O)O)....
153	4O3C	Ki = 2.57 mM	ASP	C4 H7 N O4	C([C@@H](C....
154	3RTF	-	CWD	C7 H8 Cl N3 O4	C1=C(C(=O)....
155	6FAZ	-	GLU	C5 H9 N O4	C(CC(=O)O)....
156	1MM6	ic50 = 20 nM	QUS	C5 H7 N3 O5	C([C@@H](C....
157	4F3G	Ki = 3.44 uM	KAI	C10 H15 N O4	CC(=C)[C@H....
158	4IY5	-	GLU	C5 H9 N O4	C(CC(=O)O)....
159	4F39	Ki = 3.44 uM	KAI	C10 H15 N O4	CC(=C)[C@H....
160	5FHO	-	5XN	C14 H14 Cl N6 O4	c1cc(cc(c1....
161	6HCH	-	D45	C18 H22 N4 O4 S2	CN1CNS(=O)....
162	2P2A	Ki = 0.75 uM	MP9	C14 H14 N6 O4	c1ccc(cc1)....
163	3TZA	Ki = 3.15 uM	TZG	C12 H13 Cl N2 O6	c1c(c(cc(c....
164	5NIH	Ki = 134 nM	8VE	C8 H11 N3 O4	CN1[C@H]2C....
165	3O2A	-	O30	C22 H28 F3 N5 O2 S	C1CCc2c(c(....
166	4LZ8	-	1YX	C19 H27 F N4 O4 S	CC(C)S(=O)....
167	1MQJ	ic50 = 4.76 uM	HWD	C7 H9 N3 O4	C1=CN(C(=O....
168	5NG9	Ki = 191 nM	8VN	C7 H8 N2 O5	C1[C@H]2[C....
169	5NS9	-	GLU	C5 H9 N O4	C(CC(=O)O)....
170	4F1Y	Kd = 0.96 uM	CNI	C9 H2 N4 O4	C1=C(C(=CC....
171	5ELV	Kd = 0.16 uM	5PX	C10 H12 N2 O3 S	c1cc2c(cc1....
172	6YK4	Ki = 7.89 uM	CG8	C10 H14 N4 O4	CN1CC2=C(C....
173	4U1O	-	KAI	C10 H15 N O4	CC(=C)[C@H....
174	1LBC	-	GLU	C5 H9 N O4	C(CC(=O)O)....
175	3TDJ	-	GLU	C5 H9 N O4	C(CC(=O)O)....
176	5FHN	-	5XO	C15 H16 N6 O4	Cc1cccc(c1....
177	4QF9	Ki = 37.1 uM	35K	C12 H13 N3 O4	c1cc2c(cc1....
178	1TXF	Ki = 57.2 nM	GLU	C5 H9 N O4	C(CC(=O)O)....
179	3GBB	Ki = 126 nM	MS8	C11 H17 N O6	C1C[C@@H]2....
180	5MFQ	-	2J9	C10 H11 F N2 O2 S	c1cc2c(cc1....
181	3FVN	Ki = 169 nM	9DX	C11 H17 N O7	C1CO[C@@H]....
182	1YCJ	-	GLU	C5 H9 N O4	C(CC(=O)O)....
183	3C35	-	KAI	C10 H15 N O4	CC(=C)[C@H....
184	5MFW	-	KAI	C10 H15 N O4	CC(=C)[C@H....
185	3C31	-	KAI	C10 H15 N O4	CC(=C)[C@H....
186	3FV1	Ki = 0.5 nM	DYH	C12 H20 N2 O7	CN[C@@H]1[....
187	3C34	-	KAI	C10 H15 N O4	CC(=C)[C@H....
188	2F36	-	GLU	C5 H9 N O4	C(CC(=O)O)....
189	3GBA	Ki = 0.848 nM	DYH	C12 H20 N2 O7	CN[C@@H]1[....
190	6SBT	Ki = 43 nM	L5H	C19 H12 F3 N5 O3	c1ccc(cc1)....
191	3FV2	Ki = 7.7 nM	NDZ	C11 H17 N O8	C1[C@@H]2[....
192	2QS4	Kd = 38 nM	LY5	C16 H24 F2 N2 O4	C1C[C@H]2C....
193	2QS3	Kd = 1.4 nM	UBE	C20 H19 N3 O6 S	CC1=CN(C(=....
194	2OJT	-	UBA	C14 H15 N3 O6 S	CC1=CN(C(=....
195	3C33	-	KAI	C10 H15 N O4	CC(=C)[C@H....
196	2WKY	Ki = 2.57 nM	IBC	C11 H14 N2 O4	C1CC=C(c2c....
197	2PBW	Ki = 5.56 nM	DOQ	C15 H21 N O6	C[C@H](C=C....
198	4YMB	Ki = 0.62 uM	4E7	C15 H19 N O4	CCC[C@@H]1....
199	6FZ4	Ki = 1.12 uM	EC8	C16 H9 F4 N3 O4	c1ccc(c(c1....
200	3FVG	Ki = 128 nM	MS8	C11 H17 N O6	C1C[C@@H]2....
201	3C36	-	KAI	C10 H15 N O4	CC(=C)[C@H....
202	2F34	Kd = 0.13 uM	UBA	C14 H15 N3 O6 S	CC1=CN(C(=....
203	3C32	-	KAI	C10 H15 N O4	CC(=C)[C@H....
204	2QS2	Kd = 186 nM	UBF	C13 H12 Br N3 O6 S	c1csc(c1CN....
205	4DLD	Ki = 1.5 uM	TZG	C12 H13 Cl N2 O6	c1c(c(cc(c....
206	3FVK	Ki = 1.5 nM	8DX	C11 H17 N O7	C1[C@@H](C....
207	2ZNU	Ki = 7.7 nM	NDZ	C11 H17 N O8	C1[C@@H]2[....
208	3S2V	Ki = 157 nM	3HU	C15 H13 N3 O6 S2	c1csc(c1CN....
209	2QS1	Kd = 33 nM	UB1	C14 H13 Br2 N3 O6 S	CC1=CN(C(=....
210	4E0X	-	KAI	C10 H15 N O4	CC(=C)[C@H....
211	5MFV	-	KAI	C10 H15 N O4	CC(=C)[C@H....
212	2ZNT	Ki = 0.5 nM	DYH	C12 H20 N2 O7	CN[C@@H]1[....
213	2F35	Kd = 3.94 uM	UBC	C15 H15 N3 O6	c1ccc(c(c1....
214	5NEB	Ki = 17 nM	8VE	C8 H11 N3 O4	CN1[C@H]2C....
215	1VSO	Ki = 18980 nM	AT1	C11 H19 N2 O7 P	CC(C)(C)c1....
216	5CC2	Kd = 80 uM	CKA	C10 H6 Cl N O3	c1cc2c(cc1....
217	2V3U	Kd = 1 mM	DSN	C3 H7 N O3	C([C@H](C(....
218	6JMV	-	SYM	C6 H10 N O4	C[C@H](C[C....
219	4MH5	Ki = 7.43 uM	GGL	C5 H9 N O4	C(CC(=O)O)....
220	3U92	-	KAI	C10 H15 N O4	CC(=C)[C@H....
221	4E0W	-	KAI	C10 H15 N O4	CC(=C)[C@H....
222	5O4F	Ki = 208 uM	8VE	C8 H11 N3 O4	CN1[C@H]2C....
223	4NWC	Ki = 1.74 uM	2QE	C9 H15 N O6	COC(=O)CC[....
224	4G8N	Kd = 63 nM	G8M	C7 H11 N O4	C1C[C@@H](....
225	6F28	Ki = 2.15 uM	CG8	C10 H14 N4 O4	CN1CC2=C(C....
226	5CMB	Kd = 28.3 nM	GLY	C2 H5 N O2	C(C(=O)O)N
227	4YKJ	Ki = 37 uM	ALA	C3 H7 N O2	C[C@@H](C(....
228	4YKI	Kd = 2.7 nM	GLY	C2 H5 N O2	C(C(=O)O)N
229	4YKP	-	GLY	C2 H5 N O2	C(C(=O)O)N
230	5EHM	-	OEM	C5 H9 N O4	CN[C@H](CC....
231	5EHS	-	2JJ	C5 H12 N O5 P	C(C[C@H](C....
232	5DTB	-	GLU	C5 H9 N O4	C(CC(=O)O)....
233	4F2O	Ki = 0.042 uM	QUS	C5 H7 N3 O5	C([C@@H](C....
234	3DP4	Kd = 43 nM	AMQ	C7 H10 N2 O4	Cc1c(c(no1....
235	4F22	Ki = 30.26 uM	KAI	C10 H15 N O4	CC(=C)[C@H....
236	4F3B	Ki = 1.271 uM	GLU	C5 H9 N O4	C(CC(=O)O)....
237	4F2Q	Ki = 0.042 uM	QUS	C5 H7 N3 O5	C([C@@H](C....
238	3RT8	-	CWD	C7 H8 Cl N3 O4	C1=C(C(=O)....
239	3M3F	-	P99	C16 H16 F2 N2 O4 S2	c1ccc(cc1)....
240	3LSX	-	PZI	C6 H10 N2 O2	C1CC(=O)N(....
241	3LSW	-	GLU	C5 H9 N O4	C(CC(=O)O)....
242	4WXJ	-	GLU	C5 H9 N O4	C(CC(=O)O)....
243	4H8I	-	11W	C20 H21 N3 O4	c1ccc(cc1)....
244	4BDQ	-	CYS	C3 H7 N O2 S	C([C@@H](C....
245	2XXW	-	GLU	C5 H9 N O4	C(CC(=O)O)....
246	1SD3	-	SYM	C6 H10 N O4	C[C@H](C[C....
247	2XXX	-	GLU	C5 H9 N O4	C(CC(=O)O)....
248	2XXR	-	GLU	C5 H9 N O4	C(CC(=O)O)....
249	3QXM	Ki = 33 nM	NDZ	C11 H17 N O8	C1[C@@H]2[....
250	1S9T	Ki = 253 nM	QUS	C5 H7 N3 O5	C([C@@H](C....
251	4BDR	-	KAI	C10 H15 N O4	CC(=C)[C@H....
252	2XXT	-	KAI	C10 H15 N O4	CC(=C)[C@H....
253	5CMM	-	SYM	C6 H10 N O4	C[C@H](C[C....
254	2XXU	-	GLU	C5 H9 N O4	C(CC(=O)O)....
255	4BDN	-	GLU	C5 H9 N O4	C(CC(=O)O)....
256	1S50	Ki = 1.4 uM	GLU	C5 H9 N O4	C(CC(=O)O)....
257	2XXV	-	KAI	C10 H15 N O4	CC(=C)[C@H....
258	5CMK	ic50 = 30 nM	LY5	C16 H24 F2 N2 O4	C1C[C@H]2C....
259	4BDL	-	GLU	C5 H9 N O4	C(CC(=O)O)....
260	1S7Y	Ki = 1.4 uM	GLU	C5 H9 N O4	C(CC(=O)O)....
261	1TT1	Ki = 64.6 nM	KAI	C10 H15 N O4	CC(=C)[C@H....
262	5IKB	Kd = 1.9 nM	KAI	C10 H15 N O4	CC(=C)[C@H....
263	5DT6	-	GLU	C5 H9 N O4	C(CC(=O)O)....
264	5ICT	-	GLU	C5 H9 N O4	C(CC(=O)O)....

Polypharmacology

Similar Ligands (2D)

Ligand no: 1; Ligand: SER; Similar ligands found: 33

No:	Ligand	ECFP6 Tc	MDL keys Tc
1	SER	1	1
2	DSN	1	1
3	DCY	0.65	0.84
4	CYS	0.65	0.84
5	DBB	0.6	0.692308
6	ABA	0.6	0.692308
7	2RA	0.6	0.75
8	HSE	0.590909	0.821429
9	C2N	0.571429	0.730769
10	ASN	0.545455	0.625
11	ASP	0.545455	0.714286
12	DAS	0.545455	0.714286
13	DAB	0.521739	0.724138
14	HL5	0.518519	0.814815
15	AS2	0.5	0.703704
16	NVA	0.5	0.62069
17	HCS	0.5	0.777778
18	CSO	0.5	0.636364
19	LEU	0.5	0.642857
20	API	0.5	0.633333
21	CSS	0.48	0.689655
22	DGY	0.47619	0.607143
23	DGL	0.461538	0.655172
24	GLU	0.461538	0.655172
25	GGL	0.461538	0.655172
26	ORN	0.444444	0.689655
27	SLZ	0.433333	0.625
28	DLY	0.413793	0.666667
29	11C	0.413793	0.633333
30	UN1	0.413793	0.633333
31	CME	0.40625	0.666667
32	LYS	0.4	0.645161
33	DHH	0.4	0.612903

Ligand no: 2; Ligand: GLY; Similar ligands found: 5

No:	Ligand	ECFP6 Tc	MDL keys Tc
1	GLY	1	1
2	BAL	0.5625	0.708333
3	ABU	0.473684	0.708333
4	MCR	0.466667	0.65
5	2RA	0.421053	0.692308

Similar Ligands (3D)

Ligand no: 1; Ligand: SER; Similar ligands found: 667

No:	Ligand	Similarity coefficient
1	DE2	1.0000
2	3PY	1.0000
3	TAR	1.0000
4	SMB	1.0000
5	HUI	1.0000
6	DXX	1.0000
7	39J	0.9987
8	2KT	0.9984
9	KG7	0.9971
10	1AC	0.9864
11	ALA	0.9831
12	THR	0.9831
13	LAC	0.9792
14	2OP	0.9775
15	03W	0.9773
16	HIU	0.9773
17	OXL	0.9770
18	A3B	0.9766
19	PYR	0.9754
20	MB3	0.9746
21	ALQ	0.9719
22	HBS	0.9705
23	SSN	0.9680
24	NIS	0.9669
25	VAL	0.9668
26	CAQ	0.9666
27	9YL	0.9662
28	OXM	0.9658
29	CEJ	0.9658
30	23W	0.9655
31	OXD	0.9655
32	HV2	0.9653
33	MLI	0.9641
34	9X7	0.9640
35	2HA	0.9633
36	LER	0.9628
37	MLA	0.9622
38	GOL	0.9620
39	GXV	0.9620
40	192	0.9617
41	E60	0.9616
42	HGY	0.9607
43	C5J	0.9606
44	3GR	0.9606
45	NAK	0.9601
46	IPH	0.9599
47	ALO	0.9596
48	HBR	0.9594
49	AKB	0.9593
50	DTL	0.9582
51	TF4	0.9582
52	BAL	0.9573
53	IQ0	0.9573
54	PPF	0.9561
55	273	0.9559
56	MMZ	0.9554
57	MEU	0.9552
58	PYM	0.9552
59	3OH	0.9551
60	TAY	0.9550
61	AOA	0.9542
62	TFB	0.9541
63	DAL	0.9540
64	BUQ	0.9538
65	PRS	0.9537
66	BUB	0.9537
67	2PC	0.9536
68	PRO	0.9536
69	BUO	0.9536
70	MRY	0.9535
71	KIV	0.9534
72	DMG	0.9533
73	BAQ	0.9531
74	SAR	0.9530
75	FW5	0.9526
76	AAE	0.9522
77	7EX	0.9519
78	KSW	0.9515
79	2IM	0.9514
80	BU4	0.9509
81	5Y9	0.9508
82	BMD	0.9504
83	40O	0.9503
84	BUA	0.9499
85	69O	0.9495
86	MAK	0.9494
87	CYH	0.9494
88	LEA	0.9492
89	CXL	0.9492
90	BAE	0.9490
91	MLM	0.9487
92	A2Q	0.9483
93	280	0.9478
94	ICN	0.9475
95	HYN	0.9471
96	3ZQ	0.9469
97	NVI	0.9464
98	BXO	0.9462
99	CHT	0.9459
100	XIX	0.9458
101	V1L	0.9451
102	4AX	0.9449
103	HDA	0.9443
104	MZ0	0.9442
105	DTI	0.9442
106	HRZ	0.9441
107	9PO	0.9440
108	3HL	0.9435
109	1SP	0.9434
110	LGA	0.9434
111	3HR	0.9432
112	DMI	0.9428
113	2AP	0.9427
114	HVK	0.9427
115	XAP	0.9427
116	IVA	0.9426
117	DCD	0.9426
118	3AP	0.9425
119	HAI	0.9424
120	MBN	0.9423
121	HSL	0.9422
122	GXE	0.9421
123	4AP	0.9420
124	HPY	0.9414
125	MTG	0.9411
126	BEW	0.9410
127	24T	0.9409
128	ATQ	0.9406
129	P2D	0.9405
130	ABU	0.9404
131	AMT	0.9404
132	GBL	0.9402
133	URA	0.9401
134	WOT	0.9400
135	MAE	0.9399
136	MMU	0.9396
137	T2C	0.9394
138	HZP	0.9393
139	DTT	0.9391
140	3TR	0.9387
141	8CL	0.9387
142	PRI	0.9384
143	TMT	0.9384
144	93B	0.9383
145	278	0.9380
146	ODV	0.9374
147	6SP	0.9371
148	L60	0.9368
149	HVQ	0.9368
150	SIN	0.9366
151	8X3	0.9363
152	25T	0.9362
153	FUM	0.9358
154	J1Z	0.9356
155	26D	0.9352
156	BVG	0.9351
157	ITU	0.9350
158	1DU	0.9348
159	CRS	0.9346
160	1CB	0.9344
161	3BB	0.9342
162	265	0.9339
163	3MT	0.9336
164	TP5	0.9336
165	A8C	0.9333
166	SLP	0.9331
167	TTO	0.9328
168	9TY	0.9327
169	HGQ	0.9323
170	DTU	0.9321
171	XPO	0.9321
172	IHG	0.9321
173	HBX	0.9319
174	TAU	0.9318
175	PYC	0.9318
176	FOA	0.9317
177	VX	0.9316
178	BVC	0.9313
179	MR3	0.9312
180	HOW	0.9311
181	2HE	0.9309
182	POA	0.9309
183	C21	0.9308
184	282	0.9304
185	WTZ	0.9303
186	2MZ	0.9303
187	SYN	0.9303
188	PYF	0.9301
189	1MZ	0.9300
190	H3M	0.9300
191	2AI	0.9298
192	JZ6	0.9297
193	SGL	0.9296
194	D2P	0.9293
195	MZY	0.9292
196	TMZ	0.9292
197	4HA	0.9291
198	EGD	0.9291
199	NXA	0.9288
200	2EZ	0.9285
201	5MP	0.9285
202	5KX	0.9285
203	4MZ	0.9284
204	1DH	0.9278
205	ETX	0.9277
206	CYT	0.9276
207	RCO	0.9276
208	GOA	0.9270
209	PUT	0.9267
210	NBE	0.9266
211	285	0.9266
212	HHN	0.9265
213	TZC	0.9265
214	DUC	0.9264
215	PE9	0.9263
216	23B	0.9263
217	PYG	0.9262
218	SMV	0.9261
219	4JU	0.9259
220	IDH	0.9259
221	ABN	0.9258
222	LDU	0.9257
223	4CH	0.9256
224	PY7	0.9253
225	JZ3	0.9250
226	LG3	0.9250
227	QFH	0.9250
228	HLT	0.9248
229	BVF	0.9245
230	HYP	0.9245
231	4XX	0.9242
232	3CH	0.9240
233	ECE	0.9239
234	WBU	0.9237
235	BYZ	0.9235
236	NMG	0.9234
237	DPR	0.9231
238	93Q	0.9230
239	APY	0.9230
240	B20	0.9225
241	PIH	0.9223
242	MLT	0.9222
243	TEO	0.9222
244	OXE	0.9219
245	FJO	0.9219
246	2DR	0.9219
247	URF	0.9217
248	PPI	0.9216
249	LG5	0.9215
250	HQE	0.9214
251	FP2	0.9213
252	BTL	0.9212
253	YAN	0.9211
254	GLY	0.9211
255	NK	0.9210
256	FAH	0.9209
257	THE	0.9209
258	JAB	0.9208
259	92Z	0.9207
260	4MV	0.9207
261	F3V	0.9205
262	8GF	0.9204
263	AC5	0.9203
264	PLQ	0.9201
265	CIG	0.9200
266	284	0.9200
267	L89	0.9199
268	1MR	0.9198
269	EDG	0.9198
270	4DX	0.9198
271	AMC	0.9197
272	4HO	0.9197
273	TDR	0.9195
274	1AB	0.9194
275	2AF	0.9194
276	JZ0	0.9193
277	3SS	0.9191
278	DA1	0.9189
279	ICC	0.9189
280	BNZ	0.9188
281	76X	0.9187
282	ITN	0.9186
283	ILE	0.9183
284	R8A	0.9182
285	HGW	0.9182
286	PHZ	0.9182
287	2A1	0.9181
288	HX2	0.9180
289	FPN	0.9178
290	HEW	0.9178
291	HTS	0.9178
292	2CH	0.9177
293	IOM	0.9176
294	UGC	0.9176
295	0PY	0.9175
296	1AN	0.9175
297	FMS	0.9174
298	LG4	0.9174
299	PYJ	0.9173
300	TH0	0.9173
301	RP7	0.9173
302	8LG	0.9170
303	3ZS	0.9169
304	4H2	0.9167
305	TB6	0.9167
306	R2B	0.9167
307	40E	0.9166
308	FPI	0.9166
309	PCR	0.9165
310	JBN	0.9164
311	ETM	0.9161
312	MCT	0.9161
313	ES3	0.9160
314	FLA	0.9158
315	AML	0.9157
316	25R	0.9157
317	HAE	0.9155
318	6X8	0.9153
319	5MH	0.9153
320	FCN	0.9152
321	2A3	0.9152
322	938	0.9152
323	GLV	0.9152
324	B3R	0.9151
325	OAA	0.9150
326	BRP	0.9149
327	XBZ	0.9149
328	CP	0.9147
329	PXY	0.9147
330	2MH	0.9147
331	CMS	0.9146
332	275	0.9145
333	JZ2	0.9144
334	PYZ	0.9143
335	HY3	0.9142
336	LMR	0.9140
337	P1R	0.9137
338	HSW	0.9137
339	4CL	0.9136
340	2AC	0.9136
341	DCL	0.9135
342	GAG	0.9134
343	0R0	0.9132
344	B24	0.9131
345	4ZE	0.9130
346	1MC	0.9129
347	CNH	0.9129
348	BR9	0.9127
349	HHQ	0.9126
350	NIE	0.9126
351	MWM	0.9125
352	M3T	0.9125
353	H95	0.9123
354	XYD	0.9123
355	4HS	0.9121
356	4JJ	0.9120
357	VAH	0.9117
358	HSM	0.9116
359	6UA	0.9116
360	TSZ	0.9114
361	NEQ	0.9113
362	27Y	0.9112
363	A1U	0.9111
364	286	0.9111
365	ETF	0.9110
366	SAT	0.9109
367	2MP	0.9108
368	61G	0.9106
369	34A	0.9105
370	R1X	0.9103
371	YCP	0.9102
372	PYD	0.9102
373	ICP	0.9102
374	BML	0.9102
375	RSF	0.9101
376	4JN	0.9096
377	NCM	0.9094
378	AGU	0.9093
379	JZ5	0.9091
380	J3K	0.9087
381	IPU	0.9087
382	9CL	0.9082
383	BP9	0.9082
384	2YU	0.9081
385	13D	0.9078
386	MWJ	0.9077
387	DZZ	0.9076
388	3MC	0.9076
389	CRN	0.9074
390	98J	0.9073
391	MTD	0.9071
392	IMR	0.9070
393	PAE	0.9067
394	PCA	0.9066
395	AKR	0.9062
396	PXO	0.9060
397	5UC	0.9058
398	5AC	0.9055
399	TFS	0.9051
400	YHO	0.9051
401	43M	0.9049
402	OXQ	0.9048
403	P7I	0.9047
404	3CL	0.9046
405	F50	0.9045
406	MSF	0.9045
407	COM	0.9043
408	3FA	0.9041
409	60P	0.9040
410	MPI	0.9039
411	JZ9	0.9036
412	NBZ	0.9035
413	HT4	0.9031
414	51F	0.9031
415	2CO	0.9029
416	CRD	0.9028
417	MBD	0.9028
418	FPY	0.9027
419	5JC	0.9027
420	FFP	0.9026
421	QOS	0.9025
422	ISU	0.9020
423	JZ1	0.9020
424	OHG	0.9020
425	CP2	0.9018
426	CIZ	0.9018
427	BZI	0.9018
428	4JO	0.9018
429	R3W	0.9017
430	HVB	0.9014
431	GBD	0.9014
432	0R1	0.9014
433	2CM	0.9011
434	6NA	0.9010
435	MGX	0.9008
436	TM7	0.9008
437	AX2	0.9008
438	GVH	0.9006
439	3CE	0.9005
440	VSO	0.9004
441	47J	0.9003
442	DEN	0.9002
443	2C9	0.9001
444	FLM	0.9001
445	IOL	0.9001
446	MRZ	0.9001
447	0CT	0.9000
448	BEZ	0.8998
449	GMN	0.8997
450	IUR	0.8997
451	BZF	0.8996
452	3MH	0.8995
453	14J	0.8995
454	TAN	0.8994
455	2MY	0.8994
456	9A4	0.8993
457	IND	0.8991
458	NHY	0.8988
459	EFS	0.8984
460	GG6	0.8984
461	1XX	0.8982
462	LZ1	0.8982
463	MPD	0.8978
464	NMU	0.8974
465	TM4	0.8972
466	TZZ	0.8971
467	PZA	0.8967
468	TB0	0.8963
469	IDM	0.8963
470	JZ7	0.8963
471	6MH	0.8962
472	3SY	0.8959
473	1PT	0.8958
474	1DQ	0.8957
475	2ZX	0.8955
476	NIO	0.8954
477	BAM	0.8953
478	MET	0.8949
479	6PC	0.8948
480	3AY	0.8946
481	4SD	0.8944
482	MZW	0.8944
483	WDL	0.8943
484	IT2	0.8941
485	H76	0.8938
486	DUB	0.8935
487	COI	0.8934
488	TZL	0.8934
489	ZBT	0.8934
490	NCA	0.8934
491	Z6J	0.8932
492	5ZE	0.8925
493	XYS	0.8922
494	13X	0.8921
495	PG3	0.8915
496	OPE	0.8915
497	UY7	0.8914
498	XBT	0.8910
499	MZG	0.8910
500	ALF	0.8910
501	BEN	0.8909
502	DYA	0.8907
503	XYP	0.8906
504	ATO	0.8902
505	TCV	0.8902
506	4JP	0.8901
507	VGL	0.8900
508	Y8I	0.8899
509	FUB	0.8899
510	2RH	0.8895
511	DSS	0.8892
512	TLD	0.8889
513	ADE	0.8887
514	O7U	0.8877
515	XLS	0.8875
516	PGA	0.8874
517	9SB	0.8873
518	JYD	0.8869
519	M6W	0.8869
520	M2H	0.8866
521	HBA	0.8866
522	XUL	0.8864
523	8FH	0.8863
524	S0H	0.8861
525	FQI	0.8860
526	PAV	0.8858
527	ROR	0.8857
528	UYA	0.8857
529	32O	0.8856
530	PCT	0.8854
531	AHR	0.8854
532	BR8	0.8853
533	BXA	0.8849
534	TZE	0.8849
535	7VD	0.8845
536	ERH	0.8844
537	BDR	0.8840
538	54D	0.8838
539	9X6	0.8838
540	MMQ	0.8835
541	1BP	0.8835
542	3XX	0.8831
543	UNU	0.8831
544	2XX	0.8827
545	NTN	0.8819
546	5AN	0.8819
547	KYD	0.8817
548	AC0	0.8816
549	7HP	0.8811
550	TMH	0.8809
551	SS1	0.8809
552	34V	0.8808
553	MSE	0.8806
554	4JL	0.8804
555	BZX	0.8804
556	6AI	0.8795
557	C2A	0.8792
558	RIB	0.8792
559	2K4	0.8789
560	7CZ	0.8787
561	M58	0.8787
562	OXZ	0.8786
563	4VP	0.8786
564	SAL	0.8783
565	TLA	0.8783
566	11S	0.8780
567	0TR	0.8779
568	T6C	0.8779
569	5H1	0.8778
570	7MH	0.8775
571	0MK	0.8774
572	14O	0.8772
573	RUU	0.8771
574	QSC	0.8770
575	ES9	0.8770
576	5MB	0.8770
577	5MI	0.8769
578	KMT	0.8767
579	PAF	0.8764
580	DMV	0.8763
581	FBA	0.8763
582	94N	0.8762
583	RIP	0.8762
584	FYU	0.8761
585	6HQ	0.8761
586	SEJ	0.8757
587	PBC	0.8756
588	HPA	0.8755
589	JIF	0.8753
590	PEP	0.8751
591	PBE	0.8750
592	OEM	0.8746
593	KPL	0.8743
594	4XR	0.8740
595	F60	0.8737
596	FK1	0.8736
597	BTE	0.8730
598	KOJ	0.8721
599	BE2	0.8720
600	IP0	0.8717
601	HY1	0.8716
602	RSO	0.8715
603	VNJ	0.8711
604	4SV	0.8710
605	SS2	0.8709
606	IFM	0.8706
607	DFB	0.8706
608	AZF	0.8703
609	SRT	0.8700
610	URP	0.8700
611	2AS	0.8694
612	7WG	0.8689
613	FAN	0.8687
614	3U4	0.8686
615	9A7	0.8685
616	64K	0.8684
617	ABE	0.8684
618	1LN	0.8683
619	ES6	0.8683
620	H8N	0.8681
621	YTB	0.8680
622	271	0.8678
623	HIO	0.8677
624	ARA	0.8675
625	HMH	0.8674
626	BNS	0.8674
627	3SK	0.8673
628	FP1	0.8672
629	9EW	0.8669
630	SNE	0.8667
631	FUC	0.8658
632	ZZT	0.8656
633	TH7	0.8652
634	8EZ	0.8651
635	C2B	0.8651
636	ICF	0.8645
637	F05	0.8641
638	1DV	0.8633
639	L3Q	0.8632
640	1WD	0.8630
641	FUL	0.8628
642	261	0.8626
643	FPK	0.8625
644	MED	0.8623
645	HX3	0.8621
646	PHB	0.8620
647	OK7	0.8620
648	JKE	0.8619
649	XRG	0.8617
650	3Z7	0.8610
651	DFU	0.8609
652	PPV	0.8609
653	ARB	0.8606
654	2TQ	0.8595
655	PEL	0.8589
656	I2M	0.8587
657	F81	0.8585
658	HMU	0.8583
659	SKG	0.8580
660	24B	0.8578
661	260	0.8577
662	JZ4	0.8574
663	PEA	0.8570
664	3NT	0.8551
665	CEE	0.8546
666	FUF	0.8537
667	MXN	0.8527

Ligand no: 2; Ligand: GLY; Similar ligands found: 257

No:	Ligand	Similarity coefficient
1	GLV	1.0257
2	HAE	1.0000
3	J3K	1.0000
4	61G	1.0000
5	2A1	1.0000
6	1BP	1.0000
7	2A3	1.0000
8	EDO	1.0000
9	BRJ	1.0000
10	NOE	1.0000
11	MGX	1.0000
12	F50	1.0000
13	BXA	1.0000
14	AGU	1.0000
15	PPI	1.0000
16	AKR	1.0000
17	NIE	1.0000
18	FAH	1.0000
19	GOA	1.0000
20	R3W	1.0000
21	NMU	1.0000
22	NHY	1.0000
23	F3V	1.0000
24	HVB	1.0000
25	ATO	0.9993
26	TSZ	0.9961
27	ALA	0.9954
28	OSM	0.9953
29	CP2	0.9916
30	AOA	0.9846
31	AXO	0.9840
32	3BR	0.9835
33	9A4	0.9822
34	PXO	0.9818
35	SAR	0.9798
36	GOL	0.9787
37	BU4	0.9767
38	OXL	0.9755
39	NIS	0.9748
40	DAL	0.9737
41	OXM	0.9733
42	GXV	0.9729
43	BUA	0.9721
44	3OH	0.9719
45	BMD	0.9714
46	BRP	0.9711
47	OXD	0.9705
48	TCV	0.9704
49	LAC	0.9682
50	2OP	0.9682
51	PYR	0.9679
52	HGY	0.9660
53	QPT	0.9660
54	DCE	0.9659
55	NAK	0.9647
56	6SP	0.9642
57	1CB	0.9640
58	HBR	0.9637
59	ALQ	0.9637
60	HBS	0.9620
61	4MZ	0.9600
62	2HA	0.9597
63	PYM	0.9596
64	BAQ	0.9588
65	MEU	0.9585
66	3GR	0.9582
67	2MZ	0.9581
68	GBL	0.9579
69	BUQ	0.9570
70	BUO	0.9557
71	3CL	0.9532
72	CRD	0.9528
73	3MT	0.9523
74	HOW	0.9521
75	MR3	0.9519
76	ABA	0.9519
77	1MZ	0.9512
78	MMU	0.9510
79	3ZS	0.9509
80	2AI	0.9505
81	BUB	0.9505
82	ATQ	0.9502
83	JZ6	0.9501
84	3TR	0.9493
85	ACT	0.9492
86	ETF	0.9490
87	AMT	0.9489
88	5Y9	0.9488
89	5KX	0.9481
90	13D	0.9474
91	MTG	0.9468
92	CYS	0.9457
93	BYZ	0.9442
94	ITU	0.9434
95	BXO	0.9429
96	CB0	0.9427
97	SO2	0.9425
98	SLP	0.9425
99	HP4	0.9410
100	XAP	0.9404
101	3BB	0.9398
102	MZY	0.9395
103	TF4	0.9390
104	PYZ	0.9377
105	N2O	0.9375
106	5MP	0.9367
107	9A7	0.9366
108	ES3	0.9364
109	78T	0.9358
110	AF3	0.9357
111	2PO	0.9353
112	ACM	0.9352
113	IPA	0.9348
114	BEF	0.9339
115	VSO	0.9338
116	D2P	0.9336
117	ALF	0.9326
118	HSW	0.9325
119	PZO	0.9319
120	SEY	0.9317
121	0CL	0.9309
122	TRI	0.9307
123	IMD	0.9296
124	BBU	0.9282
125	MSF	0.9276
126	MZ0	0.9268
127	HUH	0.9266
128	MMQ	0.9235
129	MSM	0.9230
130	THR	0.9220
131	2KT	0.9218
132	TAN	0.9214
133	1AC	0.9213
134	SER	0.9211
135	TB0	0.9211
136	CNH	0.9209
137	BBX	0.9200
138	PUT	0.9192
139	FW5	0.9192
140	KCS	0.9182
141	HYN	0.9182
142	BVG	0.9180
143	DE2	0.9178
144	DSN	0.9164
145	03W	0.9162
146	DGY	0.9162
147	MTD	0.9159
148	HIU	0.9155
149	KG7	0.9153
150	BVC	0.9152
151	FJO	0.9147
152	DXX	0.9145
153	XIX	0.9143
154	MB3	0.9134
155	DBB	0.9120
156	A3B	0.9120
157	3PY	0.9118
158	HAI	0.9113
159	NVI	0.9111
160	HUI	0.9110
161	B20	0.9108
162	CXL	0.9106
163	CYH	0.9106
164	P1R	0.9098
165	A2Q	0.9098
166	0PY	0.9081
167	BNZ	0.9081
168	CEJ	0.9080
169	CHT	0.9074
170	PRI	0.9073
171	ETX	0.9072
172	25T	0.9062
173	39J	0.9057
174	SMB	0.9057
175	HSL	0.9054
176	24T	0.9050
177	4AX	0.9031
178	7EX	0.9030
179	L60	0.9028
180	1SP	0.9026
181	8FH	0.9024
182	PHZ	0.9023
183	XPO	0.9019
184	2HP	0.9019
185	2EZ	0.9013
186	SGL	0.9004
187	FPO	0.8999
188	VN4	0.8993
189	BTL	0.8991
190	HVQ	0.8987
191	TAU	0.8986
192	2IM	0.8985
193	TMO	0.8985
194	IPH	0.8983
195	DTI	0.8978
196	EGD	0.8976
197	MCH	0.8975
198	E60	0.8974
199	03S	0.8974
200	DSS	0.8968
201	DMG	0.8966
202	MLA	0.8965
203	C5J	0.8965
204	HV2	0.8963
205	C2N	0.8963
206	8X3	0.8961
207	1DH	0.8953
208	MLI	0.8952
209	V1L	0.8947
210	93B	0.8943
211	9PO	0.8942
212	MMZ	0.8940
213	4AP	0.8936
214	GB	0.8936
215	SSN	0.8935
216	LGA	0.8933
217	2AP	0.8932
218	HVK	0.8932
219	PPF	0.8931
220	3AP	0.8930
221	TAY	0.8929
222	HRZ	0.8927
223	PO4	0.8927
224	MBN	0.8919
225	KSW	0.8918
226	TBU	0.8917
227	WOT	0.8907
228	DCY	0.8904
229	BF4	0.8901
230	3HL	0.8899
231	FUS	0.8896
232	ETM	0.8887
233	DMI	0.8881
234	2HE	0.8879
235	HLT	0.8876
236	COM	0.8875
237	3HR	0.8868
238	MLM	0.8864
239	GXE	0.8857
240	AAE	0.8850
241	HHN	0.8850
242	PIH	0.8844
243	8CL	0.8841
244	P7I	0.8841
245	2PA	0.8840
246	IVA	0.8825
247	9XN	0.8811
248	POA	0.8809
249	9SB	0.8792
250	WO6	0.8776
251	TTO	0.8755
252	HGW	0.8750
253	P2D	0.8688
254	ART	0.8686
255	EFS	0.8679
256	280	0.8605
257	PEJ	0.8598

Similar Binding Sites (Proteins are less than 50% similar to leader)

Pocket No.: 1; Query (leader) PDB : 4YKI; Ligand: GLY; Similar sites found with APoc: 2

This union binding pocket(no: 1) in the query (biounit: 4yki.bio1) has 15 residues
No:	Leader PDB	Ligand	Sequence Similarity
1	2RC8	DSN	40.2344
2	2RC8	DSN	40.2344

Pocket No.: 2; Query (leader) PDB : 4YKI; Ligand: GLY; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.

This union binding pocket(no: 2) in the query (biounit: 4yki.bio1) has 15 residues
No:	Leader PDB	Ligand	Sequence Similarity

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