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Receptor
PDB id Resolution Class Description Source Keywords
1LFO 2.3 Å NON-ENZYME: TRANSPORT LIVER FATTY ACID BINDING PROTEIN-OLEATE COMPLEX RATTUS NORVEGICUS INTRACELLULAR LIPID TRANSPORT PROTEIN FATTY ACID BINDING PROTEIN
Ref.: THE CRYSTAL STRUCTURE OF THE LIVER FATTY ACID-BINDING PROTEIN. A COMPLEX WITH TWO BOUND OLEATES. J.BIOL.CHEM. V. 272 7140 1997
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
BEO A:130;
Invalid;
none;
submit data
86.089 C4 H6 O2 CC=CC...
OLA A:128;
A:129;
Valid;
Valid;
none;
none;
Kd ~ 2 uM
282.461 C18 H34 O2 CCCCC...
UNX A:131;
Invalid;
none;
submit data
n/a X *
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1LFO 2.3 Å NON-ENZYME: TRANSPORT LIVER FATTY ACID BINDING PROTEIN-OLEATE COMPLEX RATTUS NORVEGICUS INTRACELLULAR LIPID TRANSPORT PROTEIN FATTY ACID BINDING PROTEIN
Ref.: THE CRYSTAL STRUCTURE OF THE LIVER FATTY ACID-BINDING PROTEIN. A COMPLEX WITH TWO BOUND OLEATES. J.BIOL.CHEM. V. 272 7140 1997
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 209 families.
1 1LFO Kd ~ 2 uM OLA C18 H34 O2 CCCCCCCCC=....
70% Homology Family (14)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 175 families.
1 1LFO Kd ~ 2 uM OLA C18 H34 O2 CCCCCCCCC=....
2 3STK - PLM C16 H32 O2 CCCCCCCCCC....
3 3VG3 - PLM C16 H32 O2 CCCCCCCCCC....
4 3B2H - PLM C16 H32 O2 CCCCCCCCCC....
5 3B2K - PLM C16 H32 O2 CCCCCCCCCC....
6 3VG6 - PLM C16 H32 O2 CCCCCCCCCC....
7 3VG5 - PLM C16 H32 O2 CCCCCCCCCC....
8 3VG7 - PLM C16 H32 O2 CCCCCCCCCC....
9 3STM - PLM C16 H32 O2 CCCCCCCCCC....
10 3VG2 - PLM C16 H32 O2 CCCCCCCCCC....
11 3B2I - PLM C16 H32 O2 CCCCCCCCCC....
12 3B2L - PLM C16 H32 O2 CCCCCCCCCC....
13 3B2J - PLM C16 H32 O2 CCCCCCCCCC....
14 3VG4 - PLM C16 H32 O2 CCCCCCCCCC....
50% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 149 families.
1 1LFO Kd ~ 2 uM OLA C18 H34 O2 CCCCCCCCC=....
2 3STK - PLM C16 H32 O2 CCCCCCCCCC....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: OLA; Similar ligands found: 56
No: Ligand ECFP6 Tc MDL keys Tc
1 OLA 1 1
2 NER 1 1
3 ELA 1 1
4 VCA 0.939394 1
5 PAM 0.939394 1
6 MYZ 0.852941 0.954545
7 EIC 0.725 0.956522
8 DCR 0.71875 0.954545
9 F15 0.71875 0.954545
10 EW8 0.71875 0.954545
11 X90 0.71875 0.954545
12 TDA 0.71875 0.954545
13 DKA 0.71875 0.954545
14 STE 0.71875 0.954545
15 MYR 0.71875 0.954545
16 11A 0.71875 0.954545
17 DAO 0.71875 0.954545
18 KNA 0.71875 0.954545
19 PLM 0.71875 0.954545
20 F23 0.71875 0.954545
21 OCA 0.6875 0.954545
22 ODD 0.675 0.956522
23 RCL 0.625 0.88
24 LNL 0.613636 0.869565
25 SHV 0.606061 0.909091
26 KTC 0.605263 0.84
27 3X1 0.564103 0.863636
28 ODT 0.555556 0.826087
29 T25 0.54717 0.709677
30 AZ1 0.53125 0.615385
31 10X 0.529412 0.645161
32 10Y 0.529412 0.645161
33 6NA 0.529412 0.863636
34 OLB 0.519231 0.617647
35 OLC 0.519231 0.617647
36 243 0.519231 0.846154
37 MVC 0.490566 0.617647
38 ACD 0.488889 0.956522
39 VA 0.478261 0.692308
40 3LA 0.47619 0.769231
41 78M 0.471698 0.617647
42 78N 0.471698 0.617647
43 EOD 0.468085 0.677419
44 MPG 0.45283 0.617647
45 14V 0.444444 0.714286
46 LEA 0.441176 0.772727
47 T24 0.438596 0.769231
48 BRC 0.435897 0.64
49 14U 0.431818 0.678571
50 M12 0.428571 0.833333
51 UNA 0.421053 0.636364
52 OCD 0.421053 0.636364
53 8YP 0.421053 0.636364
54 D0G 0.4 0.913043
55 BNV 0.4 0.913043
56 BMJ 0.4 0.913043
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1LFO; Ligand: OLA; Similar sites found with APoc: 37
This union binding pocket(no: 1) in the query (biounit: 1lfo.bio1) has 15 residues
No: Leader PDB Ligand Sequence Similarity
1 4P7U 1PS None
2 3LN9 FLC None
3 5TUX ECH None
4 5OJI NAP None
5 5ESO ISC None
6 5ESO TDP None
7 3QRC SCR 2.34375
8 3NRR D16 3.90625
9 3NRR NAP 3.90625
10 5OVK NDP 4.6875
11 3C3N FMN 4.6875
12 6EQS BV8 5.46875
13 5MDH NAD 5.46875
14 5W8Q BU4 6.25
15 3VRY B43 7.03125
16 5JFL NAD 7.03125
17 5VKI THR NGA GAL NAG 8.59375
18 3GYT DL4 8.59375
19 3B1J NAD 10.1562
20 2GAG FOA 12.5
21 2C42 TPP 12.5
22 2C42 PYR 12.5
23 5UI2 EQ3 14.8438
24 3A06 NDP 18.75
25 4MP8 NAD 18.75
26 4MP8 MLI 18.75
27 4AZP A9M 25.7812
28 5HZ5 65X 28.125
29 5HZ9 5M8 30.4688
30 3WBG 2AN 30.4688
31 4BVM PLM 31.25
32 4BVM VCA 31.25
33 2NNQ T4B 32.8125
34 5D48 L96 32.8125
35 2QM9 TDZ 32.8125
36 5BVT PAM 34.375
37 1FDQ HXA 45.3125
Pocket No.: 2; Query (leader) PDB : 1LFO; Ligand: OLA; Similar sites found with APoc: 189
This union binding pocket(no: 2) in the query (biounit: 1lfo.bio1) has 21 residues
No: Leader PDB Ligand Sequence Similarity
1 6D61 4AA None
2 5H9Q TD2 None
3 3VV1 GAL FUC None
4 1QKQ MAN None
5 4WVW SLT None
6 1SWG BTN None
7 5JSP DQY None
8 3T2W BTN None
9 6MPT C30 None
10 1WUB OTP None
11 4K55 H6P None
12 5ML3 DL3 None
13 3ZW0 FUC None
14 4IMO PWZ None
15 3ZW2 GAL FUC None
16 6HDT BTN None
17 4Z28 BTN None
18 3NV3 GAL NAG MAN None
19 3EW2 BTN None
20 1N5S ADL None
21 3E2M E2M None
22 3ZXE PGZ None
23 2F01 BTN None
24 2F01 BTQ None
25 3SAO NKN None
26 3ZW2 NAG GAL FUC None
27 3KYQ DPV None
28 6F7X MFU None
29 4GGZ BTN None
30 3R1V AZB None
31 1Z6K OAA None
32 4WN5 MVC None
33 2AG4 LP3 None
34 2WPU KYT None
35 2AG4 OLA None
36 3EEB IHP None
37 5Y72 DST None
38 4J25 OGA None
39 3ZO7 K6H None
40 1I7A PHE None
41 2QX0 PH2 None
42 6A63 LAT 1.5625
43 1WW5 SGA BGC 1.5625
44 4OPC FDA 2.34375
45 4OPC PGT 2.34375
46 4IE6 UN9 2.34375
47 5TFZ 7BC 2.34375
48 4BPZ GLC BGC BGC 2.34375
49 4MNS 2AX 3.125
50 2X34 UQ8 3.125
51 4B1M FRU FRU 3.125
52 5EZU MYR 3.37079
53 5T7I LAT NAG GAL 3.90625
54 4YLZ LAT NAG GAL 3.90625
55 1QIN GIP 3.90625
56 1UMZ BGC BGC XYS BGC XYS GAL 3.90625
57 1C1L GAL BGC 3.90625
58 5K21 6QF 3.90625
59 4RFR RHN 3.90625
60 1Y0G 8PP 3.90625
61 4JNJ BTN 4.34783
62 4CSD MFU 4.6875
63 1OFZ FUC 4.6875
64 2CM4 RCL 4.6875
65 4G7A AZM 4.6875
66 1U0A BGC BGC BGC BGC 4.6875
67 4B2Z P5S 4.6875
68 1XIM XYL 4.6875
69 5EO8 TFU 4.6875
70 1OFZ FUL 4.6875
71 5NLD LBT 5.46875
72 5X1M THG 5.46875
73 4EE7 PIS 5.46875
74 5X1M DHB 5.46875
75 4D4U FUC GAL 5.46875
76 5G48 1FL 5.46875
77 4D52 GXL 5.46875
78 4D52 GIV 5.46875
79 5DQ8 FLF 5.46875
80 5N87 N66 5.46875
81 4D4U FUC GAL NDG FUC 5.46875
82 4RYV ZEA 5.46875
83 2BS5 BGC GAL FUC 5.55556
84 3L9R L9R 6.12245
85 1ULE GLA GAL NAG 6.25
86 2HZQ STR 6.25
87 5GLT BGC GAL NAG GAL 6.25
88 1SLT NDG GAL 6.25
89 3OYW TDG 6.25
90 2OVD DAO 6.25
91 2JIG PD2 6.25
92 3LVW GSH 6.25
93 1GZW GAL BGC 6.25
94 1ZB6 GST 6.25
95 1ZB6 DIN 6.25
96 5YXC CIT 6.25
97 6B9T 2HE 6.25
98 4H6B 10X 6.25
99 1C9K 5GP 6.25
100 5LXB 7A9 6.25
101 2Z77 HE7 7.03125
102 2D6M LBT 7.03125
103 2VFT SOR 7.03125
104 4Y24 TD2 7.03125
105 2VQ5 HBA 7.03125
106 3SCH TB6 7.03125
107 2Y6Q I7T 7.03125
108 2ET1 GLV 7.03125
109 3G08 FEE 7.07071
110 3SCM LGN 7.07071
111 3QUZ QUV 7.07071
112 5H5A 6OU 7.8125
113 3E85 BSU 7.8125
114 5A69 OGN 7.8125
115 3PFG SAM 7.8125
116 3PFG TLO 7.8125
117 4ZSI 4R1 8.59375
118 2YNE YNE 8.59375
119 2YNE NHW 8.59375
120 4OKD GLC GLC GLC 8.59375
121 2R5V HHH 8.59375
122 3RUG DB6 9.375
123 3ZGJ RMN 9.375
124 3WUC GLC GAL 9.375
125 2OBD 2OB 10.1562
126 3M3E GAL A2G NPO 10.1562
127 2JDR GLY ARG PRO ARG THR THR SER PHE ALA GLU 10.1562
128 2JDR L20 10.1562
129 1Y7P RIP 10.1562
130 1OIJ AKG 10.1562
131 4CS4 AXZ 10.1562
132 5N0L ILE 10.1562
133 5FPX GLY SER SER HIS HIS HIS HIS HIS 10.6195
134 5KEW 6SB 10.6383
135 2YMZ LAT 10.9375
136 5H9P TD2 10.9375
137 5X7Q ACR 10.9375
138 5H9O GLC 10.9375
139 1J3R 6PG 10.9375
140 5ODY 9SK 10.9375
141 4IAW LIZ 10.9375
142 6FOF LAT 10.9375
143 2P7Q GG6 10.9375
144 2A1L PCW 11.7188
145 1T27 PCW 11.7188
146 3MTX PGT 11.7188
147 5IH1 6BQ 11.7188
148 5IH1 GDP 11.7188
149 5NBP BGC BGC BGC 12.5
150 3VHH VHH 13.0081
151 4F7E 0SH 13.2812
152 3PUR 2HG 13.2812
153 5BVB DOG 13.2812
154 5NN6 MIG 13.2812
155 4PSB GA3 13.2812
156 3WUD GLC GAL 14.0625
157 3WG3 A2G GAL NAG FUC 14.0625
158 4GN8 ASO 14.8438
159 1ODM ASV 14.8438
160 1NSZ GLC 15.625
161 3E8N VRA 16.4062
162 3E8N ATP 16.4062
163 5KD6 LBU 16.4062
164 5KD6 6C7 16.4062
165 3DZ6 PUT 16.4179
166 1I7M PUT 16.4179
167 1P0Z FLC 17.1875
168 5DG2 GAL GLC 17.1875
169 1A78 TDG 17.9688
170 2OVW CBI 17.9688
171 2QL9 CIT 18.75
172 4YRD 3IT 18.75
173 5LUN OGA 18.75
174 1WBI BTN 19.5312
175 3RGA LSB 21.0938
176 1LSH PLD 21.0938
177 4BJZ P3A 21.875
178 4BJZ FAD 21.875
179 3MKK GLC BGC 21.875
180 4WO4 JLS 22
181 5JHD GLY ILE LEU GLY PHE VAL PHE THR LEU 22
182 1OGA GLY ILE LEU GLY PHE VAL PHE THR LEU 22
183 5WL1 CUY 22.2222
184 1Z03 OCH 22.6562
185 3VSV XYP 26.5625
186 5XEG AKG 28.125
187 2IFB PLM 44.5312
188 5XNA SHV 47.6562
189 4QYN RTL 48.4375
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