-->
Receptor
PDB id Resolution Class Description Source Keywords
2IMG 1.93 Å EC: 3.1.3.16 CRYSTAL STRUCTURE OF DUAL SPECIFICITY PROTEIN PHOSPHATASE 23 FROM HOMO SAPIENS IN COMPLEX WITH LIGAND MALATE ION HOMO SAPIENS DUSP23 VHZ LDP-3 DUAL SPECICITY PROTEIN PHOSPHATASE 23 DUS23_HUMAN MALATE 8673A STRUCTURAL GENOMICS PSI PROTEIN STRUCTURE INITIATIVE NEW YORK SGX RESEARCH CENTER FOR STRUCTURAL GENOMICS NYSGXRC HYDROLASE
Ref.: STRUCTURE OF HUMAN DUAL SPECIFICITY PROTEIN PHOSPHATASE 23, VHZ, ENZYME-SUBSTRATE/PRODUCT COMPLEX. J.BIOL.CHEM. V. 283 8946 2008
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
MLT A:501;
Valid;
none;
submit data
134.087 C4 H6 O5 C([C@...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2IMG 1.93 Å EC: 3.1.3.16 CRYSTAL STRUCTURE OF DUAL SPECIFICITY PROTEIN PHOSPHATASE 23 FROM HOMO SAPIENS IN COMPLEX WITH LIGAND MALATE ION HOMO SAPIENS DUSP23 VHZ LDP-3 DUAL SPECICITY PROTEIN PHOSPHATASE 23 DUS23_HUMAN MALATE 8673A STRUCTURAL GENOMICS PSI PROTEIN STRUCTURE INITIATIVE NEW YORK SGX RESEARCH CENTER FOR STRUCTURAL GENOMICS NYSGXRC HYDROLASE
Ref.: STRUCTURE OF HUMAN DUAL SPECIFICITY PROTEIN PHOSPHATASE 23, VHZ, ENZYME-SUBSTRATE/PRODUCT COMPLEX. J.BIOL.CHEM. V. 283 8946 2008
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 20 families.
1 2IMG - MLT C4 H6 O5 C([C@H](C(....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 15 families.
1 2IMG - MLT C4 H6 O5 C([C@H](C(....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 13 families.
1 2IMG - MLT C4 H6 O5 C([C@H](C(....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: MLT; Similar ligands found: 12
No: Ligand ECFP6 Tc MDL keys Tc
1 LMR 1 1
2 MLT 1 1
3 DMR 1 1
4 DGY 0.52381 0.818182
5 3HG 0.52381 0.761905
6 3HL 0.5 0.666667
7 3HR 0.5 0.666667
8 TRC 0.478261 0.666667
9 S2G 0.461538 0.809524
10 2HG 0.461538 0.809524
11 2RH 0.458333 0.652174
12 ICT 0.444444 0.904762
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2IMG; Ligand: MLT; Similar sites found with APoc: 227
This union binding pocket(no: 1) in the query (biounit: 2img.bio1) has 11 residues
No: Leader PDB Ligand Sequence Similarity
1 5A89 ADP None
2 5A89 FMN None
3 2VBU CDP None
4 154L NAG NAG NAG None
5 1JDC GLC GLC GLC GLC None
6 3LU1 NAD None
7 1LOJ URI None
8 3IID APR None
9 1XXA ARG None
10 1H74 ADP None
11 1LOJ U None
12 1PR9 NAP None
13 4HEQ FMN None
14 1ZGS XMM 1.3245
15 1OBV FMN 1.3245
16 4R57 ACO 1.3245
17 1QZR CDX 1.98676
18 1QZR ANP 1.98676
19 5W3K NDP 1.98676
20 1XTT U5P 1.98676
21 5W3K 9TY 1.98676
22 2AIB ERG 2.04082
23 5N5S NAP 2.64901
24 3A4V PYR 2.64901
25 4TSK NDP 2.64901
26 1EB1 ZAL PRO MMO 2.64901
27 2ANK N12 2.64901
28 2ANM CDO 2.64901
29 2A2X NA9 2.64901
30 1A8U BEZ 2.64901
31 5Z69 AGS 2.64901
32 4Q5M ROC 2.64901
33 3A4V NAD 2.64901
34 5KQG 6VX 3.31126
35 5BVE 4VG 3.31126
36 5OF9 ANP 3.31126
37 2FR1 NDP 3.31126
38 1LH0 PRP 3.31126
39 1LH0 ORO 3.31126
40 3WQQ IB3 3.31126
41 3WQQ NDP 3.31126
42 3PH4 AOS 3.31126
43 3RFV 15L 3.31126
44 2QE0 NAP 3.31126
45 2CFC NAD 3.31126
46 4UTG ANP 3.31126
47 1WD4 AHR 3.31126
48 1E6W NAD 3.31126
49 3RFV NAI 3.31126
50 1T57 FMN 3.31126
51 1P0F NAP 3.31126
52 5K2M ADP 3.31126
53 2BES RES 3.48837
54 3K7S R52 3.97351
55 5U61 7WG 3.97351
56 2X6T NAP 3.97351
57 6BA2 7KM 3.97351
58 4B7X NAP 3.97351
59 2QXX TTP 3.97351
60 5G4L NDP 3.97351
61 2YG3 FAD 3.97351
62 5X40 ACP 3.97351
63 4XDY NAI 3.97351
64 1GQ2 NAP 3.97351
65 2X2T GAL NGA 3.97351
66 3FVQ ATP 3.97351
67 1JQI FAD 3.97351
68 2PK3 A2R 3.97351
69 1EQ2 NAP 3.97351
70 1SOW NAD 3.97351
71 3D36 ADP 3.97351
72 1PVS 7HP 4.63576
73 4JB1 NAP 4.63576
74 4JB1 FAD 4.63576
75 4WZH FMN 4.63576
76 2F3R G5P 4.63576
77 1Z0K GTP 4.63576
78 2JLR ANP 4.63576
79 2WOX NDP 4.63576
80 1QK3 5GP 4.63576
81 5K4W THR 4.63576
82 3EYA FAD 4.63576
83 2WHX ADP 4.63576
84 1O5O U5P 4.63576
85 9LDB NAD 4.63576
86 1T90 NAD 4.63576
87 4U7W NDP 4.63576
88 6F9Q NAD 4.63576
89 6DVH FMN 4.63576
90 5GK9 ACO 4.63576
91 9LDT NAD 4.63576
92 1U2Z SAH 4.63576
93 3HGM ATP 4.7619
94 1D1Q 4NP 5.29801
95 4MIG G3F 5.29801
96 2NYA MGD 5.29801
97 3IWK NAD 5.29801
98 5MZY 8EZ 5.29801
99 1E2K TMC 5.29801
100 5XJ7 87O 5.29801
101 5X20 NAD 5.29801
102 3WGT FAD 5.29801
103 4PZ2 NAD 5.29801
104 5IUW IAC 5.29801
105 4YCA NDP 5.29801
106 4NBU NAI 5.29801
107 5IUW NAD 5.29801
108 1F2U ATP 5.40541
109 4LFL TG6 5.96026
110 5WS9 AMP 5.96026
111 4XDZ NDP 5.96026
112 5UJ3 CE4 5.96026
113 3QKT ANP 5.96026
114 5XWV NDP 5.96026
115 3OIX FMN 5.96026
116 1TLL FMN 5.96026
117 2OHH FMN 5.96026
118 1OPK MYR 5.96026
119 5GXU FMN 5.96026
120 4D86 ADP 5.96026
121 4FMS BDP 5.96026
122 2WET FAD 5.96026
123 1D1T NAD 5.96026
124 2D5A COA 6.25
125 3Q9N COA 6.38298
126 1ZXM ANP 6.62252
127 1YJQ NAP 6.62252
128 1RM4 NDP 6.62252
129 2YVJ NAI 6.62252
130 2BP1 NDP 6.62252
131 4L2I FAD 6.62252
132 2Q4W FAD 6.62252
133 2C91 NAP 6.62252
134 4A59 AMP 6.62252
135 4I3V NAD 6.62252
136 4B2D FBP 7.28477
137 5E4R NAP 7.28477
138 4AUT FAD 7.28477
139 3O03 NAP 7.28477
140 3HQP FDP 7.28477
141 4FN4 NAD 7.28477
142 3HEE R5P 7.38255
143 2OZ5 7XY 7.94702
144 4IP7 FBP 7.94702
145 4RKK GLC GLC GLC GLC GLC GLC 7.94702
146 4P8K 38C 7.94702
147 4P8K FAD 7.94702
148 2YCH ATP 7.94702
149 3QCJ NX4 7.94702
150 3QF7 ANP 7.94702
151 2ZW5 COA 7.94702
152 1QMG APX 7.94702
153 4PYH GLC GLC GLC GLC GLC GLC 7.94702
154 2FT0 ACO 7.94702
155 5OCM NAP 7.94702
156 3O5N BR0 8.03571
157 4IPE ANP 8.60927
158 1S16 ANP 8.60927
159 4HXY NDP 8.60927
160 3HVJ 705 8.60927
161 2A9K GDP 8.60927
162 1CER NAD 8.60927
163 2R75 01G 8.60927
164 1ZSQ PIB 9.27152
165 4P4M D3T 9.27152
166 3PXP MYR 9.27152
167 3ORF NAD 9.27152
168 2VZZ SCA 9.27152
169 1OGD RIP 9.92366
170 1CX9 NHP 9.93377
171 3C3N FMN 9.93377
172 5EYP GDP 9.93377
173 4L2H AR6 AR6 9.93377
174 5L13 6ZE 9.93377
175 5VN0 NAI 9.93377
176 3RLF ANP 10.596
177 2PO3 T4K 10.596
178 2Q9U FMN 10.596
179 5H68 AGS 10.596
180 4DE1 0J6 11.2583
181 6BT6 3GK 11.2583
182 3EFV NAD 11.2583
183 4DDS 0J7 11.2583
184 2A14 SAH 11.9205
185 1BVY FMN 11.9205
186 3SIG AR6 11.9205
187 6BYF CIT 12.5828
188 6CMJ F6J 12.5828
189 1E5D FMN 12.5828
190 2ZFZ ARG 12.6582
191 5EIN NAP 12.963
192 1PA9 CSN 13.245
193 4WZ8 3W7 13.245
194 1E8G FAD 13.245
195 1E8G FCR 13.245
196 5NC9 8SZ 13.245
197 1XKQ NDP 13.245
198 5N1P 8GK 13.245
199 1U26 IHS 13.9073
200 4KQW NAP 13.9073
201 2FCR FMN 13.9073
202 3DR4 G4M 13.9073
203 1H0H 2MD 14.5695
204 3TO7 COA 14.5695
205 4KP7 1UQ 15.2318
206 4KP7 NAP 15.2318
207 2P3T 993 15.3846
208 3QV1 NAD 15.8537
209 5GUD 2IT 15.894
210 5GUD NDP 15.894
211 2H04 4UN 17.2185
212 5XFV FMN 17.2185
213 3P9Y N7P THR SEP PRO SER TYR SET 17.8808
214 5LY3 ADP 18.543
215 4KYQ FLC 19.8675
216 3V0H I3P 19.8675
217 6AMI TRP 19.8675
218 6AM8 PLT 19.8675
219 3O5X JZG 21.1921
220 4GE6 B26 23.8411
221 2B5W NAP 24.5033
222 5OVX AY5 25.8278
223 1JZS MRC 25.8278
224 4J51 N75 27.8146
225 2CNE DFJ 28.4768
226 3RGQ 5P5 37.7483
227 1OHE ACE ALA SEP PRO 43.7086
APoc FAQ
Feedback