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Receptor
PDB id Resolution Class Description Source Keywords
1I0B 1.3 Å EC: 3.1.8.1 HIGH RESOLUTION STRUCTURE OF THE MANGANESE-CONTAINING PHOSPHOTRIESTERASE FROM PSEUDOMONAS DIMINUTA BREVUNDIMONAS DIMINUTA PTE HYDROLASE MANGANESE
Ref.: HIGH RESOLUTION X-RAY STRUCTURES OF DIFFERENT METAL-SUBSTITUTED FORMS OF PHOSPHOTRIESTERASE FROM PSEUDOMONAS DIMINUTA. BIOCHEMISTRY V. 40 2712 2001
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
EDO A:408;
A:410;
A:411;
A:412;
A:413;
A:417;
A:419;
A:420;
A:424;
A:427;
A:430;
A:432;
B:407;
B:409;
B:414;
B:415;
B:416;
B:418;
B:421;
B:422;
B:423;
B:425;
B:426;
B:428;
B:429;
B:431;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
62.068 C2 H6 O2 C(CO)...
FMT A:369;
B:369;
Invalid;
Invalid;
none;
none;
submit data
46.025 C H2 O2 C(=O)...
MN A:401;
A:402;
B:401;
B:402;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
none;
none;
none;
none;
submit data
54.938 Mn [Mn+2...
NA A:405;
B:406;
Part of Protein;
Part of Protein;
none;
none;
submit data
22.99 Na [Na+]
PEL A:434;
B:433;
Valid;
Valid;
none;
none;
submit data
122.164 C8 H10 O c1ccc...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1I0B 1.3 Å EC: 3.1.8.1 HIGH RESOLUTION STRUCTURE OF THE MANGANESE-CONTAINING PHOSPHOTRIESTERASE FROM PSEUDOMONAS DIMINUTA BREVUNDIMONAS DIMINUTA PTE HYDROLASE MANGANESE
Ref.: HIGH RESOLUTION X-RAY STRUCTURES OF DIFFERENT METAL-SUBSTITUTED FORMS OF PHOSPHOTRIESTERASE FROM PSEUDOMONAS DIMINUTA. BIOCHEMISTRY V. 40 2712 2001
Members (24)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 5 families.
1 2R1K - DPF C4 H11 O4 P CCOP(=O)(O....
2 1EZ2 - DII C7 H17 O3 P CC(C)OP(=O....
3 1JGM - PEL C8 H10 O c1ccc(cc1)....
4 2D2H - TZZ C3 H9 O4 P COP(=O)(OC....
5 3C86 - DPJ C4 H11 O3 P S CCOP(=S)(O....
6 1EYW - TEN C6 H15 O4 P CCOP(=O)(O....
7 3OOD - EPL C11 H17 O5 P CCOP(=O)(O....
8 3E3H - EBP C12 H19 O3 P CCOP(=O)(C....
9 3URQ - QMP C7 H15 O3 P CP(=O)(O)O....
10 3A3W - EPL C11 H17 O5 P CCOP(=O)(O....
11 1I0B - PEL C8 H10 O c1ccc(cc1)....
12 1HZY - PEL C8 H10 O c1ccc(cc1)....
13 3CAK - DPF C4 H11 O4 P CCOP(=O)(O....
14 1DPM - EBP C12 H19 O3 P CCOP(=O)(C....
15 2R1P - DPJ C4 H11 O3 P S CCOP(=S)(O....
16 1P6C - EBP C12 H19 O3 P CCOP(=O)(C....
17 1I0D - PEL C8 H10 O c1ccc(cc1)....
18 3UR5 - DPF C4 H11 O4 P CCOP(=O)(O....
19 2R1M - DPF C4 H11 O4 P CCOP(=O)(O....
20 2D2G - DZZ C2 H7 O3 P S COP(=S)(O)....
21 1QW7 - EBP C12 H19 O3 P CCOP(=O)(C....
22 2R1N - EPL C11 H17 O5 P CCOP(=O)(O....
23 2R1L - DPJ C4 H11 O3 P S CCOP(=S)(O....
24 4NP7 - DPJ C4 H11 O3 P S CCOP(=S)(O....
70% Homology Family (29)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 2R1K - DPF C4 H11 O4 P CCOP(=O)(O....
2 1EZ2 - DII C7 H17 O3 P CC(C)OP(=O....
3 1JGM - PEL C8 H10 O c1ccc(cc1)....
4 2D2H - TZZ C3 H9 O4 P COP(=O)(OC....
5 3C86 - DPJ C4 H11 O3 P S CCOP(=S)(O....
6 1EYW - TEN C6 H15 O4 P CCOP(=O)(O....
7 3OOD - EPL C11 H17 O5 P CCOP(=O)(O....
8 3E3H - EBP C12 H19 O3 P CCOP(=O)(C....
9 3URQ - QMP C7 H15 O3 P CP(=O)(O)O....
10 3A3W - EPL C11 H17 O5 P CCOP(=O)(O....
11 1I0B - PEL C8 H10 O c1ccc(cc1)....
12 1HZY - PEL C8 H10 O c1ccc(cc1)....
13 3CAK - DPF C4 H11 O4 P CCOP(=O)(O....
14 1DPM - EBP C12 H19 O3 P CCOP(=O)(C....
15 2R1P - DPJ C4 H11 O3 P S CCOP(=S)(O....
16 1P6C - EBP C12 H19 O3 P CCOP(=O)(C....
17 1I0D - PEL C8 H10 O c1ccc(cc1)....
18 3UR5 - DPF C4 H11 O4 P CCOP(=O)(O....
19 2R1M - DPF C4 H11 O4 P CCOP(=O)(O....
20 2D2G - DZZ C2 H7 O3 P S COP(=S)(O)....
21 1QW7 - EBP C12 H19 O3 P CCOP(=O)(C....
22 2R1N - EPL C11 H17 O5 P CCOP(=O)(O....
23 2R1L - DPJ C4 H11 O3 P S CCOP(=S)(O....
24 4NP7 - DPJ C4 H11 O3 P S CCOP(=S)(O....
25 1PSC - EBP C12 H19 O3 P CCOP(=O)(C....
26 1P6B - EFS C2 H7 O4 P CCOP(=O)(O....
27 3URB - DPF C4 H11 O4 P CCOP(=O)(O....
28 3URN - QMP C7 H15 O3 P CP(=O)(O)O....
29 4E3T - HLN C16 H21 O3 P CCCCCCP(=O....
50% Homology Family (34)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 2R1K - DPF C4 H11 O4 P CCOP(=O)(O....
2 1EZ2 - DII C7 H17 O3 P CC(C)OP(=O....
3 1JGM - PEL C8 H10 O c1ccc(cc1)....
4 2D2H - TZZ C3 H9 O4 P COP(=O)(OC....
5 3C86 - DPJ C4 H11 O3 P S CCOP(=S)(O....
6 1EYW - TEN C6 H15 O4 P CCOP(=O)(O....
7 3OOD - EPL C11 H17 O5 P CCOP(=O)(O....
8 3E3H - EBP C12 H19 O3 P CCOP(=O)(C....
9 3URQ - QMP C7 H15 O3 P CP(=O)(O)O....
10 3A3W - EPL C11 H17 O5 P CCOP(=O)(O....
11 1I0B - PEL C8 H10 O c1ccc(cc1)....
12 1HZY - PEL C8 H10 O c1ccc(cc1)....
13 3CAK - DPF C4 H11 O4 P CCOP(=O)(O....
14 1DPM - EBP C12 H19 O3 P CCOP(=O)(C....
15 2R1P - DPJ C4 H11 O3 P S CCOP(=S)(O....
16 1P6C - EBP C12 H19 O3 P CCOP(=O)(C....
17 1I0D - PEL C8 H10 O c1ccc(cc1)....
18 3UR5 - DPF C4 H11 O4 P CCOP(=O)(O....
19 2R1M - DPF C4 H11 O4 P CCOP(=O)(O....
20 2D2G - DZZ C2 H7 O3 P S COP(=S)(O)....
21 1QW7 - EBP C12 H19 O3 P CCOP(=O)(C....
22 2R1N - EPL C11 H17 O5 P CCOP(=O)(O....
23 2R1L - DPJ C4 H11 O3 P S CCOP(=S)(O....
24 4NP7 - DPJ C4 H11 O3 P S CCOP(=S)(O....
25 1PSC - EBP C12 H19 O3 P CCOP(=O)(C....
26 1P6B - EFS C2 H7 O4 P CCOP(=O)(O....
27 3URB - DPF C4 H11 O4 P CCOP(=O)(O....
28 3URN - QMP C7 H15 O3 P CP(=O)(O)O....
29 4RDZ - MYR C14 H28 O2 CCCCCCCCCC....
30 4E3T - HLN C16 H21 O3 P CCCCCCP(=O....
31 4H9X - HL4 C8 H13 N O3 CCCC(=O)N[....
32 4H9T - HL4 C8 H13 N O3 CCCC(=O)N[....
33 4KF1 - HT5 C14 H26 N O2 S CCCCCCCCCC....
34 2VC7 Ki = 432 uM HT5 C14 H26 N O2 S CCCCCCCCCC....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: PEL; Similar ligands found: 3
No: Ligand ECFP6 Tc MDL keys Tc
1 PEL 1 1
2 YRL 0.433333 0.65
3 4FA 0.419355 0.684211
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1I0B; Ligand: PEL; Similar sites found with APoc: 507
This union binding pocket(no: 1) in the query (biounit: 1i0b.bio1) has 9 residues
No: Leader PDB Ligand Sequence Similarity
1 4RJD TFP None
2 2RKN LP3 None
3 4F4S EFO None
4 5AYV NAP 0.647249
5 4DXJ IPE 0.903614
6 4DXJ 0M9 0.903614
7 2C9E PID 0.917431
8 3KMZ EQO 1.12782
9 3G5N PB2 1.20482
10 5J7X FAD 1.20482
11 4JZX 476 1.20482
12 3D04 SAK 1.25786
13 5BQI 4UL 1.2987
14 5BQI GSH 1.2987
15 2O07 SPD 1.31579
16 3GJ5 GDP 1.35747
17 3GJ3 GDP 1.35747
18 5BXQ GDP 1.38889
19 4FC7 NAP 1.44404
20 4FC7 COA 1.44404
21 2A1L PCW 1.48148
22 4CDN FO1 1.50602
23 4CDN FAD 1.50602
24 6BMS PLM 1.50602
25 3UZO GLU 1.50602
26 3UR0 SVR 1.50602
27 5TH5 7C5 1.52091
28 5NWI TYR PHE SER SEP ASN 1.52672
29 3KCC CMP 1.53846
30 1Z06 GNP 1.5873
31 5N5U 7N8 1.59236
32 5B4B LP5 1.6129
33 6CS8 F9Y 1.65016
34 3QKD HI0 1.65746
35 1XHL NDP 1.6835
36 3ET1 ET1 1.71821
37 5M37 9SZ 1.73913
38 1KPG SAH 1.74216
39 1KPG 16A 1.74216
40 3SP6 IL2 1.75439
41 3KDU NKS 1.80505
42 2Z7I 742 1.80723
43 3P5P A3C 1.80723
44 1UOU CMU 1.80723
45 5G57 6M5 1.80723
46 4IEN COA 1.84049
47 3ZLR X0B 1.89873
48 3E85 BSU 1.89873
49 3SUD SUE 1.97044
50 1W6U HXC 1.98676
51 5L3V GDP 2.00669
52 2ZCQ B65 2.04778
53 2EIX FAD 2.05761
54 3LDW ZOL 2.10843
55 6C1R EFD 2.10843
56 5K7K 6RJ 2.10843
57 1JQI CAA 2.10843
58 5Y24 GLY MET PRO ARG GLY ALA 2.10843
59 4DV8 0LX 2.10843
60 5L13 6ZE 2.10843
61 4AZJ SEP PLP 2.10843
62 3LDW IPE 2.10843
63 5W7R SAH 2.10843
64 5LX9 OLB 2.11268
65 5LX9 OLA 2.11268
66 2WCJ M21 2.12766
67 3KYF 5GP 5GP 2.1645
68 4B7P 9UN 2.17391
69 5T9E NAP 2.21402
70 1DMH LIO 2.2508
71 5K53 STE 2.29008
72 2NNQ T4B 2.29008
73 3WDM ADN 2.29885
74 1SR7 MOF 2.3166
75 4OAR 2S0 2.32558
76 3QMK SGN IDS SGN IDS 2.33645
77 3NHT U46 2.36486
78 6BR8 6OU 2.38095
79 3F8C HT1 2.38095
80 1LOX RS7 2.40964
81 3WCA FPS 2.40964
82 2GMH UQ5 2.40964
83 4ONA UW1 2.40964
84 3RHJ NAP 2.40964
85 6F5W KG1 2.40964
86 4WAS COO 2.40964
87 4WAS NAP 2.40964
88 2HI4 BHF 2.40964
89 3TTC ADP 2.40964
90 4PGK Y69 2.45902
91 4YV5 SVR 2.45902
92 4HBM 0Y7 2.5
93 2ZFZ ARG 2.53165
94 4RHP PEF 2.55319
95 1WPY BTN 2.55319
96 5T9F TYR 2.58303
97 5T9F NAP 2.58303
98 2WJG GDP 2.65957
99 4LY9 S6P 2.66876
100 4LY9 1YY 2.66876
101 5D9J 0N8 2.6738
102 1VP5 NAP 2.68456
103 4NON GDP 2.69231
104 4M73 M72 2.71084
105 4M73 SAH 2.71084
106 5AHS COA 2.71084
107 5C2H 4XU 2.71084
108 5C2H 4PX 2.71084
109 1FCH TYR GLN SER LYS LEU 2.71084
110 3HR1 PF9 2.71084
111 3V66 D3A 2.71084
112 4KIB SAH 2.71084
113 5W7D PX8 2.71084
114 1I8T FAD 2.71084
115 4PPF FLC 2.71084
116 2BVL UDP 2.71084
117 2BVL GLC 2.71084
118 1D6H COA 2.71084
119 3LN0 52B 2.71084
120 4KCF AKM 2.71084
121 4JD3 PLM 2.71084
122 3VMF GTP 2.71084
123 1SVK ALF GDP 2.71084
124 1BII ARG GLY PRO GLY ARG ALA PHE VAL THR ILE 2.71084
125 4CE5 PDG 2.71084
126 2VK4 TPP 2.71084
127 5HCV 60R 2.72374
128 2IVN ANP 2.72727
129 1YOK P6L 2.73438
130 5CYV WCA 2.73973
131 1YUC EPH 2.7451
132 5B0W 22B 2.74914
133 1KPH SAH 2.78746
134 3G08 FEE 2.80702
135 5FKP 6UL 2.80702
136 5UNJ RJW 2.85714
137 4WT2 3UD 2.85714
138 1ZDU P3A 2.85714
139 2EVL GAL SPH EIC 2.87081
140 8CAT NDP 3.01205
141 2WH8 II2 3.01205
142 5N9T 8QQ 3.01205
143 3SDV 911 3.01205
144 5T8U LPA 3.01205
145 2VL8 UDP 3.01205
146 2VL8 CTS 3.01205
147 1SKQ GDP 3.01205
148 5U3F 7TS 3.01205
149 5YV5 ADP 3.01205
150 1U1I NAD 3.01205
151 2OOR TXP 3.01205
152 3T6E UQ9 3.10078
153 4OAS 2SW 3.125
154 4F0B GDS 3.125
155 2PX6 DH9 3.16456
156 3P8N L4T 3.22581
157 4DKX GDP 3.24074
158 3FON VAL ASN ASP ILE PHE GLU ALA ILE 3.28467
159 1GNI OLA 3.31325
160 5IKH 6BW 3.31325
161 3OTH CLJ 3.31325
162 2HKJ RDC 3.31325
163 1ZXM ANP 3.31325
164 4L1F COS 3.31325
165 1ZGA HMK 3.31325
166 3WY9 GDP 3.31325
167 5W76 GDP 3.31325
168 2RH1 CAU 3.31325
169 2RH1 CLR 3.31325
170 4ETZ C2E 3.367
171 4RFM 3P6 3.38346
172 5K52 OCD 3.39623
173 2KCE D16 3.40909
174 1DKF BMS 3.43348
175 1DKF OLA 3.43348
176 2ART LPA AMP 3.43511
177 4POJ 2VP 3.4632
178 6GL8 F3Q 3.48837
179 5AEI LYS ARG LYS ARG LYS ARG LYS ARG LYS ARG 3.4965
180 4P6X HCY 3.52941
181 1MHC FME TYR PHE ILE ASN ILE LEU THR LEU 3.5461
182 3OV6 MK0 3.61446
183 1RX0 2MC 3.61446
184 4M52 FAD 3.61446
185 2E9L BGC 3.61446
186 1CZA ADP 3.61446
187 2FXU BID 3.61446
188 5ZKC 3C0 3.61446
189 4B47 GDP 3.61446
190 1U3D FAD 3.61446
191 4M52 M52 3.61446
192 4RKK GLC GLC GLC GLC GLC GLC 3.61446
193 4CVZ TYR GLU LEU ASP GLU LYS PHE ASP ARG LEU 3.64742
194 1M2O GNP 3.68421
195 4DOL PLM 3.68664
196 4R98 GNH 3.69004
197 5OJL TXP 3.69128
198 3TMK T5A 3.7037
199 1POC GEL 3.73134
200 2WIC GNP 3.74532
201 5DRB 5FJ 3.78007
202 4DE1 0J6 3.80228
203 6BT6 3GK 3.80228
204 4DE3 DN8 3.80228
205 4DDS 0J7 3.80228
206 4UAA 3GK 3.80228
207 4UA7 3GK 3.80228
208 3VHZ L2P GLC MAN SGA 3.81679
209 1FZQ GDP 3.8674
210 1IYE PGU 3.8835
211 3L9R L9R 3.88693
212 3L9R L9Q 3.88693
213 2R0N TGC 3.91566
214 2C5A NAD 3.91566
215 2C5A GDC 3.91566
216 4I8P NAD 3.91566
217 3U6B GDP 3.91566
218 5JBQ GDP 3.91566
219 2WME NAP 3.91566
220 4G5G GDP 3.91566
221 2QK4 ATP 3.91566
222 6A5Y 9CR 3.94737
223 4OIV XX9 3.9823
224 2HJ3 FAD 4
225 3RLF MAL 4.05405
226 2FK8 SAM 4.08805
227 1H9G COA MYR 4.11523
228 1BUC CAA 4.21687
229 4DJA DLZ 4.21687
230 4DJA FAD 4.21687
231 1XM4 PIL 4.21687
232 1XMU ROF 4.21687
233 1XMY ROL 4.21687
234 2OBD PCW 4.21687
235 1LVK MNT BEF 4.21687
236 6CGN DA 4.21687
237 2W83 GTP 4.24242
238 5HMC 5NE 4.25532
239 1JR8 FAD 4.2735
240 4FDV 0UK 4.30622
241 5CHR 4NC 4.37956
242 1TMX HGX 4.43686
243 2XSU PIE 4.48718
244 1OLM VTQ 4.51807
245 1JQ5 NAD 4.51807
246 3A7R LAQ 4.51807
247 4B7H NDP 4.51807
248 5MW4 5JU 4.51807
249 3V2U GLA 4.51807
250 4J0Q GDP 4.51807
251 5HWO HMG 4.51807
252 3UMV FAD 4.51807
253 3FAL REA 4.51807
254 4IS0 1R4 4.56432
255 1QSM ACO 4.60526
256 1KSH GDP 4.60526
257 5G3N X28 4.72441
258 4JZ8 CIT 4.73186
259 2BHW LUX 4.74138
260 5XK9 DMA 4.74138
261 5XK9 GST 4.74138
262 3WYJ H78 4.74308
263 5K3W PLP 4.79233
264 3ET3 ET1 4.79452
265 5CX6 CDP 4.81928
266 4A0M NAD 4.81928
267 2BJK NAD 4.81928
268 2FKW RG1 4.87805
269 1ZPD CIT 4.92958
270 5G5W R8C 5
271 3KYQ DPV 5.02513
272 4MNS 2AX 5.03145
273 6CC0 EWM 5.06329
274 3ABA FLI 5.12048
275 5UQK U2F 5.12048
276 1YRB GDP 5.12048
277 5THZ SAH 5.12048
278 5THY SAH 5.12048
279 5TDF ADE 5.12048
280 2GBB CIT 5.12821
281 1LN1 DLP 5.14019
282 5UGW GSH 5.14286
283 3H0A D30 5.14706
284 4K49 HFQ 5.14706
285 1FM9 9CR 5.14706
286 3G9E RO7 5.16605
287 5J6D 6H5 5.21173
288 4CL6 7SB 5.26316
289 4R29 SAM 5.35714
290 5LJ0 6XX 5.38462
291 4OMJ 2TX 5.39568
292 5EEH SAH 5.42169
293 5EEH P9P 5.42169
294 3O0Q GDP 5.42169
295 3O0Q ADN 5.42169
296 3O0Q TTP 5.42169
297 4ELG 52I 5.42169
298 4ELG 52J 5.42169
299 3H0L ADP 5.42169
300 3BZ3 YAM 5.43478
301 3EVG SAH 5.45455
302 2J1P GRG 5.46075
303 3BQD DAY 5.4902
304 4H6U ACO 5.5
305 3O01 DXC 5.51948
306 3U5S FAD 5.55556
307 1TPY SAH 5.57491
308 5W7B MYR 5.67376
309 3AB3 GDP 5.69106
310 4XRZ SI6 5.72289
311 1XVB 3BR 5.72289
312 4DCT GDP 5.72289
313 5WGG SAM 5.72289
314 5GUE GGS 5.74018
315 4KVX ACO 5.76923
316 1D5Z ACE ALC ARG ALA ODA SER LEU NH2 5.85774
317 4TUO SIA GAL SIA GLC NGA 5.90909
318 6BYM HC3 5.91133
319 3B6C SDN 5.98291
320 4DW4 U5P 5.98802
321 4ZI2 GNP 6.01504
322 2CYE COA 6.01504
323 1P1M MET 6.0241
324 4UUG PXG 6.0241
325 3OJO NAD 6.0241
326 3B99 U51 6.0241
327 4OHY ANP 6.0241
328 3CNL GNP 6.10687
329 3KRO DST 6.20438
330 3KRO IPE 6.20438
331 1N8V BDD 6.25
332 3Q8G PEE 6.25
333 4GOJ GNP 6.25
334 2JBZ COA 6.29371
335 3TPV ADE 6.3253
336 5A8E XTK 6.34921
337 2X77 GDP 6.34921
338 4F7E 0SH 6.36042
339 2ODE ALF GDP 6.38298
340 1OQC FAD 6.4
341 3MBG FAD 6.47482
342 2E2R 2OH 6.55738
343 3T1O GDP 6.56566
344 4OHU 2TK 6.57439
345 4OHU NAD 6.57439
346 2JC9 ADN 6.62651
347 6D6Y SAH 6.62651
348 1EWF PC1 6.62651
349 5UC1 486 6.75676
350 3SFI 3SF 6.77966
351 3DAA PDD 6.85921
352 1XW6 GSH 6.88073
353 2DSA HPX 6.89655
354 2DSA GSH 6.89655
355 4YLG GDP 6.93642
356 4RLT FSE 6.96203
357 1RQJ RIS 7.02341
358 1B4B ARG 7.04225
359 5HGR 45D 7.07692
360 1EQ2 NAP 7.09677
361 6CAY ERG 7.10059
362 3O55 FAD 7.2
363 4J56 FAD 7.22892
364 1WDK N8E 7.22892
365 3EC1 GDP 7.22892
366 4Z5W TYS ILE TYS THR GLN 7.22892
367 1T0S BML 7.27273
368 2WPW ACO 7.37463
369 2I0G I0G 7.393
370 5V4R MGT 7.40741
371 4DXD 9PC 7.53012
372 2P1C GG3 7.53012
373 3DNT ATP 7.53012
374 1UDY CS8 7.53012
375 2Q2Y MKR 7.53012
376 2Q2Y ADP 7.53012
377 4INB 1F6 7.53425
378 3TL1 JRO 7.54717
379 1NRJ GTP 7.59494
380 2VZZ SCA 7.79817
381 2D5Z L35 7.80142
382 1G7S GDP 7.83133
383 5FG3 GDP 7.83133
384 3KP6 SAL 7.94702
385 1YP0 PEF 7.94979
386 2EV1 OLA 8.10811
387 5XDT GDP 8.11688
388 4Q86 AMP 8.13253
389 3GWT 066 8.13253
390 2XBK XBK 8.13253
391 5OHJ 9VE 8.13253
392 2YG3 FAD 8.13253
393 6G14 G4P 8.16327
394 4H2V AMP 8.18182
395 2AX9 BHM 8.20312
396 1Z08 GNP 8.23529
397 4KWD JF2 8.28025
398 3W5J GDP 8.33333
399 1KJM ALA GLN PHE SER ALA SER ALA SER ARG 8.42105
400 3B96 MYA 8.43373
401 2HQM FAD 8.43373
402 3BJK CIT 8.49673
403 3IIS PID 8.60927
404 5AZC PGT 8.66667
405 5AAV GW5 8.73016
406 2FZH DH1 8.73786
407 5NTP 98E 8.82353
408 3ANP DAO 8.82353
409 3ANP DCC 8.82353
410 2QE4 JJ3 8.87097
411 2WOR 2AN 9
412 1M7G AV2 9.00474
413 1M7G ADX 9.00474
414 4ZGM 32M 9.01639
415 1MKY GDP 9.03614
416 1M13 HYF 9.17722
417 4ZCC FAD 9.22619
418 6FA4 D1W 9.24856
419 1HK8 DGT 9.63855
420 2BCG GER 9.63855
421 4RD0 GDP 9.63855
422 1DJL NAP 9.66184
423 1NHK CMP 9.72222
424 2FH5 GTP 9.81308
425 4XIZ LPP 10
426 3GZ9 D32 10.0372
427 4NDO ATP 10.1449
428 3L1N PLM 10.3093
429 4AIG FLX 10.4478
430 4X6F 3XU 10.4762
431 5IXK 6EW 10.5263
432 2E3N 6CM 10.5882
433 3KPB SAM 10.6557
434 4P3Y GDP 10.989
435 6GH1 ARG LEU PRO ALA LYS ALA PRO LEU LEU 11
436 4WO4 JLS 11
437 3KYO LYS LEU PRO ALA GLN PHE TYR ILE LEU 11
438 5C9J STE 11.1111
439 5WL1 CUY 11.1111
440 5WL1 D3D 11.1111
441 5C9J DAO 11.1111
442 2J8C U10 11.1538
443 2J8C SPO 11.1538
444 4V0K GDP 11.2426
445 3RUG DB6 11.2745
446 4UHL VFV 11.4458
447 2FYU FDN 11.5385
448 4U82 FPS 11.7188
449 1XON PIL 11.747
450 3G4G D71 11.747
451 2QN6 GDP 11.828
452 4XU6 TDA 11.9048
453 1YKI FMN 11.9816
454 4NB5 2JT 12.2807
455 1ELI PYC 12.5964
456 3G58 988 12.6506
457 3KXC PLM 12.8866
458 4ZB6 GDS 13.0045
459 2I7C AAT 13.0742
460 3RMK BML 13.253
461 5F1R 42O 13.5021
462 2V1O COA 13.9073
463 2HW2 RFP 14.6853
464 3RET PYR 14.8515
465 3RET SAL 14.8515
466 2Y69 CHD 15.1316
467 1NU4 MLA 15.4639
468 1BWO LPC 15.5556
469 5LWY OLA 15.8879
470 2HFP NSI 15.9574
471 1RDT 570 16.1972
472 3B1M KRC 16.2544
473 1FQJ GDP 16.3265
474 1LEK GLU GLN TYR LYS PHE TYR SER VAL 16.4234
475 5U98 1KX 16.6065
476 5U98 VAL THR THR ASP ILE GLN VAL LYS VAL 16.6065
477 5T70 THR SER ASN LEU GLN GLU GLN ILE GLY TRP 16.6667
478 5XS3 VAL ARG SER ARG ARG CYS LEU ARG LEU 16.8498
479 3QUZ QUV 18.1818
480 3SCM LGN 18.3575
481 5CSD ACD 19.4969
482 1QZR CDX 19.8795
483 1QZR ANP 19.8795
484 2P1O IHP 20
485 2P1O NLA 20
486 5ZCO PEK 21.4286
487 5Z84 TGL 21.4286
488 5ZCO CHD 21.4286
489 5Z84 CHD 21.4286
490 2DYS TGL 21.4286
491 5ZCO TGL 21.4286
492 2DYS PEK 21.4286
493 2DYR TGL 21.4286
494 5Z84 PEK 21.4286
495 2DYR PEK 21.4286
496 3HUJ AGH 22.0096
497 4OGQ 2WA 22.5806
498 4OGQ SQD 22.5806
499 3ZCB ATP 22.5806
500 4OGQ 7PH 22.5806
501 4OGQ BCR 22.5806
502 5MWE TCE 22.8571
503 5MT9 SRO 23.3333
504 3ZC7 ATP 23.8095
505 5C0C ARG GLN PHE GLY PRO ASP TRP ILE VAL ALA 24.5487
506 5ISZ GLY ILE LEU GLY PHE VAL PHE THR LEU 24.7273
507 4V1T ADP 28.125
Pocket No.: 2; Query (leader) PDB : 1I0B; Ligand: PEL; Similar sites found with APoc: 124
This union binding pocket(no: 2) in the query (biounit: 1i0b.bio1) has 9 residues
No: Leader PDB Ligand Sequence Similarity
1 4I67 G G G RPC None
2 1D5C GDP None
3 1R4A GNP None
4 1ZD9 GDP 1.06383
5 3GJ4 GDP 1.35747
6 3GJ0 GDP 1.35747
7 3CH5 GDP 1.38889
8 2C77 GNP 1.50602
9 1P72 ADP 1.50602
10 2XTZ GSP 1.50602
11 3UZO PLP 1.50602
12 2BME GNP 1.6129
13 2WOE AR6 1.67224
14 2Y8E GNP 1.67598
15 2IYL GDP 1.76056
16 1VPM COA 1.77515
17 1ZCB GDP 1.80723
18 4TMN 0PK 1.89873
19 4M4Q 21A 2.07469
20 5KOK SAH 2.10843
21 4FR3 0V4 2.13675
22 4C9G CXT 2.20126
23 1S8F GDP 2.25989
24 2GJ8 ALF GDP 2.32558
25 1R2Q GNP 2.35294
26 5H7J GCP 2.40964
27 6CIB ADP 2.40964
28 2F5Z FAD 2.40964
29 6CI7 ACP 2.40964
30 1L1E SAH 2.43902
31 5XJ8 NKO 2.48756
32 5XJ7 87O 2.48756
33 4XDA ADP 2.589
34 4M9Q GNP 2.64317
35 3T34 GDP 2.71084
36 1YQT ADP 2.71084
37 4JD3 COA 2.71084
38 2UYT LRH 2.71084
39 2UYT ADP 2.71084
40 5L3R GCP 2.73038
41 3CX8 GSP 2.95567
42 1FCZ 156 2.97872
43 4ZBR DIF 3.01205
44 4ZBR NPS 3.01205
45 1OYJ GSH 3.0303
46 6ECU SAH 3.16456
47 1A8R GTP 3.16742
48 3GGO NAI 3.18471
49 3GGO ENO 3.18471
50 2A9G ARG 3.31325
51 4V03 ADP 3.50195
52 3RAB GNP 3.5503
53 2WTN FER 3.58566
54 2E9L PLM 3.61446
55 1PJS NAD 3.61446
56 1Y3A GDP 3.64742
57 1I2L DCS 3.71747
58 4DDY DN6 3.80228
59 2WZV FMN 3.82979
60 2BVN GNP 3.91566
61 3AKK ADP 4
62 3HGM ATP 4.08163
63 2FFQ GSP 4.09357
64 1ZJ6 G3D 4.27807
65 4MO2 FDA 4.34783
66 5YT0 GDP 4.51807
67 4I6G FAD 4.51807
68 3Q85 GNP 4.73373
69 5W7M SAH 4.80769
70 2AG4 LP3 4.87805
71 2AG4 OLA 4.87805
72 2BNE U5P 4.97925
73 3GJ7 GDP 5.10204
74 1JNQ EGT 5.42169
75 1NST A3P 5.53846
76 2HCJ GDP 5.72289
77 5M04 GDP 5.72289
78 5CJH 522 5.72289
79 4U63 FAD 5.72289
80 1YZQ GNP 5.88235
81 1VG8 GNP 6.28019
82 1VG0 GDP 6.28019
83 5DHF GNP 6.3253
84 1KY3 GDP 6.59341
85 3T5G GDP 6.62983
86 6BSX GDP 6.74157
87 1FP6 ADP 6.92042
88 1VG9 GDP 7.02703
89 1VG1 GDP 7.02703
90 3FRH SAH 7.11462
91 5I49 2KH 7.22892
92 5LEF GTP 7.57576
93 1O6B ADP 7.69231
94 2CJW GDP 7.8125
95 3ZL8 ADP 7.83133
96 5XDT MB3 8.11688
97 2ZEJ GDP 8.15217
98 4RC8 STE 8.55856
99 5TB5 GDP 8.64865
100 1EK0 GNP 8.82353
101 1TU3 GNP 8.86076
102 1PUJ GNP 9.21986
103 3KTA AP5 9.89011
104 5Z2M GTP 10.1449
105 5KD8 TNR 10.241
106 3A4T SFG 10.5839
107 5C4L 4XR 11.215
108 5ECP MET 11.6592
109 5ECP ATP 11.6592
110 5ECP JAA 11.6592
111 5BV6 35G 11.8421
112 4XTR ADP 11.9816
113 4K81 GTP 12.4031
114 1UYY BGC BGC 12.9771
115 6EVN PRO PRO GLY PRO ALA GLY PRO PRO GLY 13.7255
116 1Z0K GTP 15.942
117 2RFX LEU SER SER PRO VAL THR LYS SER PHE 16.7273
118 5DI3 GNP 16.7568
119 2XCF BBQ 17.3913
120 3KEE 30B 17.3913
121 3BC1 GNP 18.6441
122 2QTV GNP 20.4082
123 1OGA GLY ILE LEU GLY PHE VAL PHE THR LEU 24.6377
124 3MJH GTP 26.4706
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