Receptor
PDB id Resolution Class Description Source Keywords
5XU9 1.17 Å EC: 2.2.1.1 CRYSTAL STRUCTURE OF TRANSKETOLASE IN COMPLEX WITH TPP INTER AND GAUCHE FORM ERYTHROSE-4-PHOSPHATE FROM PICHIA STIPITIS SCHEFFERSOMYCES STIPITIS CBS 6054 TRANSKETOLASE TRANSFERASE
Ref.: EVIDENCE OF DIRADICALS INVOLVED IN THE YEAST TRANSK CATALYZED KETO-TRANSFERRING REACTIONS. CHEMBIOCHEM V. 19 2395 2018
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
PEG A:703;
A:706;
A:707;
A:708;
A:704;
A:705;
A:702;
 Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
 none;
none;
none;
none;
none;
none;
none;
 submit data
106.12 C4 H10 O3 C(COC...
8N9 A:709;
 Valid;
 none;
 submit data
484.358 C14 H22 N4 O9 P2 S Cc1nc...
CA A:701;
 Part of Protein;
 none;
 submit data
40.078 Ca [Ca+2...
E4P A:710;
 Valid;
 none;
 submit data
200.084 C4 H9 O7 P C([C@...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
5XU2 0.97 Å EC: 2.2.1.1 CRYSTAL STRUCTURE OF TRANSKETOLASE IN COMPLEX WITH TPP_III A FRUCTOSE-6-PHOSPHATE FROM PICHIA STIPITIS SCHEFFERSOMYCES STIPITIS CBS 6054 TRANSKETOLASE TRANSFERASE
Ref.: EVIDENCE OF DIRADICALS INVOLVED IN THE YEAST TRANSK CATALYZED KETO-TRANSFERRING REACTIONS. CHEMBIOCHEM V. 19 2395 2018
Members (21)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 7 families.
1 5HYV - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
2 5XSA - 8EL C12 H20 N4 O7 P2 S Cc1ncc(c(n....
3 5I5E - 5SP C5 H11 O8 P C([C@H]([C....
4 5XU9 - 8N9 C14 H22 N4 O9 P2 S Cc1ncc(c(n....
5 5XRV - F6R C6 H13 O9 P C([C@H]([C....
6 5XS6 - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
7 5XSB - 8EL C12 H20 N4 O7 P2 S Cc1ncc(c(n....
8 5XSM - 8EO C12 H21 N4 O7 P2 S Cc1ncc(c(n....
9 5XUF - 8FL C12 H20 N4 O8 P2 S Cc1ncc(c(n....
10 5XVT - 8FL C12 H20 N4 O8 P2 S Cc1ncc(c(n....
11 5XTV - 8EF C12 H20 N4 O7 P2 S Cc1ncc(c(n....
12 5XQK - T5X C17 H30 N4 O15 P3 S Cc1c(sc([n....
13 5XPS - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
14 5I51 - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
15 5XU2 - F6R C6 H13 O9 P C([C@H]([C....
16 5XT4 - T6F C18 H32 N4 O16 P3 S Cc1c(sc([n....
17 5XTX - 8ML C18 H33 N4 O16 P3 S Cc1ncc(c(n....
18 5XT0 - T6F C18 H32 N4 O16 P3 S Cc1c(sc([n....
19 5XQA - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
20 5XTL - 8GF C5 H7 N3 Cc1nccc(n1....
21 5HJE - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
70% Homology Family (25)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 5 families.
1 1NGS - E4P C4 H9 O7 P C([C@H]([C....
2 1TKB Kd = 0.000000064 M N1T C13 H19 N3 O7 P2 S Cc1ccc(c(n....
3 1TRK - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
4 1GPU - THD C14 H22 N4 O9 P2 S Cc1ncc(c(n....
5 5HYV - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
6 5XSA - 8EL C12 H20 N4 O7 P2 S Cc1ncc(c(n....
7 5I5E - 5SP C5 H11 O8 P C([C@H]([C....
8 5XU9 - 8N9 C14 H22 N4 O9 P2 S Cc1ncc(c(n....
9 5XRV - F6R C6 H13 O9 P C([C@H]([C....
10 5XS6 - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
11 5XSB - 8EL C12 H20 N4 O7 P2 S Cc1ncc(c(n....
12 5XSM - 8EO C12 H21 N4 O7 P2 S Cc1ncc(c(n....
13 5XUF - 8FL C12 H20 N4 O8 P2 S Cc1ncc(c(n....
14 5XVT - 8FL C12 H20 N4 O8 P2 S Cc1ncc(c(n....
15 5XTV - 8EF C12 H20 N4 O7 P2 S Cc1ncc(c(n....
16 5XQK - T5X C17 H30 N4 O15 P3 S Cc1c(sc([n....
17 5XPS - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
18 5I51 - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
19 5XU2 - F6R C6 H13 O9 P C([C@H]([C....
20 5XT4 - T6F C18 H32 N4 O16 P3 S Cc1c(sc([n....
21 5XTX - 8ML C18 H33 N4 O16 P3 S Cc1ncc(c(n....
22 5XT0 - T6F C18 H32 N4 O16 P3 S Cc1c(sc([n....
23 5XQA - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
24 5XTL - 8GF C5 H7 N3 Cc1nccc(n1....
25 5HJE - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
50% Homology Family (35)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1R9J - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
2 1NGS - E4P C4 H9 O7 P C([C@H]([C....
3 1TKB Kd = 0.000000064 M N1T C13 H19 N3 O7 P2 S Cc1ccc(c(n....
4 1TRK - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
5 1GPU - THD C14 H22 N4 O9 P2 S Cc1ncc(c(n....
6 5HYV - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
7 5XSA - 8EL C12 H20 N4 O7 P2 S Cc1ncc(c(n....
8 5I5E - 5SP C5 H11 O8 P C([C@H]([C....
9 5XU9 - 8N9 C14 H22 N4 O9 P2 S Cc1ncc(c(n....
10 5XRV - F6R C6 H13 O9 P C([C@H]([C....
11 5XS6 - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
12 5XSB - 8EL C12 H20 N4 O7 P2 S Cc1ncc(c(n....
13 5XSM - 8EO C12 H21 N4 O7 P2 S Cc1ncc(c(n....
14 5XUF - 8FL C12 H20 N4 O8 P2 S Cc1ncc(c(n....
15 5XVT - 8FL C12 H20 N4 O8 P2 S Cc1ncc(c(n....
16 5XTV - 8EF C12 H20 N4 O7 P2 S Cc1ncc(c(n....
17 5XQK - T5X C17 H30 N4 O15 P3 S Cc1c(sc([n....
18 5XPS - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
19 5I51 - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
20 5XU2 - F6R C6 H13 O9 P C([C@H]([C....
21 5XT4 - T6F C18 H32 N4 O16 P3 S Cc1c(sc([n....
22 5XTX - 8ML C18 H33 N4 O16 P3 S Cc1ncc(c(n....
23 5XT0 - T6F C18 H32 N4 O16 P3 S Cc1c(sc([n....
24 5XQA - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
25 5XTL - 8GF C5 H7 N3 Cc1nccc(n1....
26 5HJE - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
27 5ND5 - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
28 6TJ8 - NDQ C12 H19 N4 O8 P2 S Cc1c(sc[n+....
29 6TJ9 - 5SP C5 H11 O8 P C([C@H]([C....
30 1QGD - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
31 2R5N Kd = 700 uM R5P C5 H11 O8 P C(C(C(C(C=....
32 2R8O - T5X C17 H30 N4 O15 P3 S Cc1c(sc([n....
33 2R8P - T6F C18 H32 N4 O16 P3 S Cc1c(sc([n....
34 5HHT - TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
35 1ITZ - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: 8N9; Similar ligands found: 24
No: Ligand ECFP6 Tc MDL keys Tc
1 8N9 1 1
2 THD 1 1
3 TDN 0.864198 0.9375
4 TDM 0.804878 0.936709
5 TD7 0.804598 0.914634
6 TZD 0.682353 0.855422
7 8FL 0.55914 0.865854
8 8EL 0.55914 0.865854
9 QSP 0.528302 0.939024
10 ZP1 0.491071 0.927711
11 8EF 0.445545 0.809524
12 TPU 0.443299 0.752941
13 TPW 0.424242 0.775
14 S1T 0.423077 0.7875
15 R1T 0.423077 0.7875
16 1TP 0.422018 0.890244
17 TDW 0.419048 0.864198
18 PYI 0.411765 0.743902
19 TPP 0.411765 0.839506
20 1U0 0.411215 0.8375
21 G8G 0.405941 0.804878
22 HTL 0.40566 0.853659
23 TOG 0.401786 0.845238
24 THY 0.4 0.843373
Ligand no: 2; Ligand: E4P; Similar ligands found: 37
No: Ligand ECFP6 Tc MDL keys Tc
1 E4P 1 1
2 R5P 0.647059 0.939394
3 R52 0.647059 0.939394
4 G6Q 0.611111 0.939394
5 HG3 0.566667 0.90625
6 LX1 0.558824 0.828571
7 M2P 0.53125 0.882353
8 GOS 0.53125 0.882353
9 G3H 0.515152 0.967742
10 DXP 0.486486 0.939394
11 DX5 0.472222 0.805556
12 A5P 0.472222 0.805556
13 LXP 0.472222 0.805556
14 DEZ 0.459459 0.911765
15 S6P 0.459459 0.828571
16 DER 0.459459 0.911765
17 4TP 0.435897 0.756098
18 TX4 0.435897 0.630435
19 DG6 0.435897 0.783784
20 LRY 0.425532 0.72093
21 HMS 0.425 0.861111
22 PA5 0.425 0.911765
23 5SP 0.425 0.861111
24 5RP 0.425 0.861111
25 R10 0.425 0.911765
26 RES 0.414634 0.673913
27 AGP 0.414634 0.674419
28 M6R 0.414634 0.674419
29 RUB 0.414634 0.911765
30 XBP 0.414634 0.911765
31 1GP 0.411765 0.878788
32 G3P 0.411765 0.878788
33 F6R 0.404762 0.885714
34 XDP 0.404762 0.833333
35 TG6 0.404762 0.885714
36 6PG 0.404762 0.911765
37 LG6 0.404762 0.911765
Similar Ligands (3D)
Ligand no: 1; Ligand: 8N9; Similar ligands found: 12
No: Ligand Similarity coefficient
1 AUJ 0.9295
2 THV 0.9290
3 5SR 0.9227
4 TDP COI 0.8990
5 WWF 0.8978
6 TDL 0.8976
7 TPP PYR 0.8975
8 8EO 0.8895
9 TD6 0.8813
10 TDP 0.8650
11 HE3 0.8631
12 TDK 0.8560
Ligand no: 2; Ligand: E4P; Similar ligands found: 739
No: Ligand Similarity coefficient
1 FOM 0.9643
2 3PG 0.9626
3 SG3 0.9595
4 DHM 0.9568
5 1X4 0.9568
6 HPV 0.9525
7 9GB 0.9458
8 Q9Z 0.9453
9 QFJ 0.9444
10 CCD 0.9436
11 4LR 0.9416
12 OSE 0.9412
13 CHH 0.9391
14 MSL 0.9383
15 13P 0.9374
16 AKG 0.9373
17 1AE 0.9369
18 SEP 0.9368
19 AT3 0.9363
20 GWM 0.9348
21 3S5 0.9339
22 EVF 0.9336
23 HC4 0.9330
24 RP3 0.9319
25 DGL 0.9318
26 OGA 0.9317
27 P81 0.9310
28 MES 0.9307
29 PGH 0.9306
30 2HG 0.9303
31 7BC 0.9302
32 QMP 0.9296
33 LUQ 0.9289
34 IP8 0.9288
35 2PG 0.9286
36 GLN 0.9263
37 RTK 0.9248
38 LTL 0.9246
39 PC 0.9246
40 AMS 0.9246
41 GGB 0.9244
42 8WO 0.9243
43 KPA 0.9240
44 DZA 0.9240
45 BCH 0.9238
46 GVM 0.9231
47 2JJ 0.9228
48 MAJ 0.9227
49 GLU 0.9227
50 ZEC 0.9224
51 GPJ 0.9223
52 152 0.9221
53 D5X 0.9215
54 4HP 0.9215
55 129 0.9213
56 Z70 0.9211
57 GPF 0.9206
58 F98 0.9206
59 TYL 0.9192
60 CYX 0.9190
61 4JC 0.9189
62 7OD 0.9181
63 1SA 0.9173
64 MP5 0.9171
65 XIZ 0.9170
66 5LD 0.9168
67 88L 0.9167
68 NM3 0.9167
69 B85 0.9166
70 ACH 0.9165
71 ZGL 0.9163
72 4NZ 0.9163
73 NSB 0.9162
74 GP9 0.9158
75 FM4 0.9157
76 X0V 0.9154
77 2IT 0.9149
78 TCA 0.9148
79 5OY 0.9148
80 SYC 0.9148
81 CCE 0.9146
82 9ON 0.9144
83 URQ 0.9139
84 ATX 0.9137
85 O45 0.9136
86 HSX 0.9134
87 PEP 0.9134
88 TSU 0.9131
89 KBZ 0.9127
90 DIR 0.9125
91 8U3 0.9125
92 NF3 0.9124
93 5DL 0.9119
94 1FD 0.9117
95 UA5 0.9117
96 PPT 0.9117
97 ABF 0.9116
98 9J3 0.9111
99 TZP 0.9108
100 DA4 0.9108
101 36E 0.9106
102 S2G 0.9102
103 KDG 0.9100
104 5LA 0.9100
105 AHN 0.9100
106 DGN 0.9098
107 DLY 0.9097
108 650 0.9095
109 4NS 0.9093
110 11C 0.9092
111 CPZ 0.9090
112 HIS 0.9090
113 SAN 0.9089
114 FCR 0.9088
115 SOL 0.9087
116 ENW 0.9084
117 2FM 0.9084
118 CS2 0.9081
119 A5E 0.9078
120 HPS 0.9078
121 M4S 0.9077
122 4J8 0.9076
123 S0E 0.9076
124 EN1 0.9075
125 KPC 0.9074
126 TYC 0.9073
127 Q04 0.9072
128 HDL 0.9072
129 DXG 0.9068
130 REL 0.9066
131 DHI 0.9065
132 HBU 0.9064
133 7UC 0.9063
134 STT 0.9062
135 4CM 0.9062
136 IOS 0.9058
137 3YP 0.9058
138 DPN 0.9058
139 4SX 0.9056
140 1HS 0.9054
141 36Y 0.9054
142 SOR 0.9053
143 2HC 0.9051
144 SKF 0.9049
145 TYE 0.9048
146 MSR 0.9048
147 AZM 0.9047
148 MTL 0.9047
149 BHU 0.9047
150 SNU 0.9043
151 PO6 0.9039
152 UN1 0.9038
153 TYR 0.9037
154 MF3 0.9037
155 AAS 0.9033
156 FBS 0.9033
157 7C3 0.9033
158 AHC 0.9032
159 CXP 0.9031
160 TZF 0.9031
161 HPP 0.9029
162 RP5 0.9028
163 TPO 0.9027
164 ANN 0.9027
165 OOG 0.9026
166 EUE 0.9026
167 URP 0.9025
168 P22 0.9023
169 AM4 0.9019
170 4FH 0.9018
171 1F1 0.9018
172 PRO GLY 0.9017
173 2BX 0.9015
174 S7A 0.9014
175 DHY 0.9013
176 GLO 0.9012
177 NFA 0.9008
178 CCU 0.9007
179 PSJ 0.9007
180 URO 0.9007
181 STX 0.9007
182 PNZ 0.9002
183 0CG 0.9002
184 C1M 0.9002
185 GGL 0.9002
186 2FT 0.9002
187 FBF 0.9001
188 PMF 0.8994
189 2QC 0.8989
190 FUD 0.8989
191 8GL 0.8988
192 R20 0.8985
193 PFF 0.8984
194 LYS 0.8984
195 PHE 0.8983
196 ONL 0.8983
197 DHC 0.8983
198 3LR 0.8983
199 DTY 0.8982
200 3W8 0.8981
201 DAL DAL 0.8981
202 ENO 0.8979
203 BL0 0.8978
204 MMS 0.8977
205 C82 0.8977
206 Q06 0.8977
207 GUA 0.8972
208 HIC 0.8971
209 MVH 0.8970
210 ZON 0.8970
211 5XB 0.8969
212 BP7 0.8969
213 54Z 0.8969
214 4NP 0.8969
215 MZM 0.8967
216 GRF 0.8967
217 HCI 0.8966
218 S0W 0.8964
219 SDD 0.8963
220 P9E 0.8962
221 LYN 0.8961
222 XYH 0.8961
223 8SZ 0.8961
224 X48 0.8961
225 INO 0.8959
226 EKZ 0.8959
227 SSC 0.8958
228 F4K 0.8958
229 API 0.8957
230 IAC 0.8957
231 CFA 0.8956
232 4LV 0.8955
233 LGT 0.8953
234 7MW 0.8951
235 PNP 0.8951
236 0V5 0.8947
237 N9J 0.8945
238 J0Z 0.8944
239 RUJ 0.8943
240 1PS 0.8943
241 NLE 0.8942
242 OW4 0.8941
243 PH3 0.8941
244 0VT 0.8941
245 FHC 0.8940
246 2ZM 0.8938
247 P23 0.8936
248 B3U 0.8935
249 ENV 0.8932
250 61M 0.8931
251 HGA 0.8931
252 FIX 0.8931
253 IFP 0.8929
254 3PO 0.8927
255 QUS 0.8927
256 BPW 0.8926
257 AOT 0.8925
258 XCG 0.8925
259 XRX 0.8924
260 A7N 0.8924
261 OVM 0.8924
262 TB8 0.8923
263 4TB 0.8922
264 AES 0.8922
265 7O4 0.8922
266 RAT 0.8922
267 0HN 0.8920
268 3QM 0.8920
269 KMH 0.8920
270 4BY 0.8919
271 P7Y 0.8917
272 MZT 0.8917
273 PMV 0.8916
274 E79 0.8916
275 EXD 0.8916
276 ISA 0.8915
277 M1T 0.8915
278 12T 0.8914
279 0L1 0.8914
280 SME 0.8914
281 FK8 0.8913
282 4LW 0.8913
283 3BU 0.8911
284 GCO 0.8911
285 ESX 0.8910
286 MHO 0.8909
287 BZ2 0.8909
288 BNF 0.8909
289 2HO 0.8908
290 HHH 0.8908
291 4WL 0.8908
292 GVY 0.8907
293 PPY 0.8907
294 92G 0.8906
295 MPV 0.8905
296 AOS 0.8904
297 80G 0.8904
298 M3L 0.8904
299 HFA 0.8903
300 4MB 0.8901
301 NNH 0.8901
302 4NC 0.8900
303 6FZ 0.8899
304 PRA 0.8898
305 HF2 0.8897
306 Z13 0.8896
307 3ZB 0.8893
308 GO2 0.8892
309 UNJ 0.8891
310 F90 0.8889
311 AFS 0.8887
312 657 0.8887
313 HSA 0.8886
314 DHB 0.8885
315 6NI 0.8884
316 B41 0.8883
317 SSB 0.8882
318 3C4 0.8882
319 5OO 0.8881
320 0HO 0.8880
321 AMH 0.8880
322 ALE 0.8880
323 TAG 0.8880
324 PBA 0.8879
325 Q02 0.8878
326 TIH 0.8877
327 EYV 0.8875
328 HQJ 0.8874
329 LVD 0.8874
330 ICB 0.8874
331 BGT 0.8874
332 LLH 0.8874
333 ZYX 0.8873
334 0NX 0.8873
335 1SH 0.8872
336 UFV 0.8871
337 6NT 0.8871
338 4JE 0.8871
339 4BF 0.8870
340 AEG 0.8870
341 LFC 0.8870
342 GB5 0.8870
343 64Z 0.8869
344 GLR 0.8869
345 TSR 0.8868
346 YF3 0.8866
347 OEG 0.8866
348 HJH 0.8864
349 DDU 0.8864
350 0A9 0.8864
351 GAE 0.8862
352 1BN 0.8862
353 SPV 0.8862
354 Y4L 0.8861
355 MYJ 0.8860
356 4BL 0.8860
357 PLR 0.8859
358 6DP 0.8859
359 BPN 0.8857
360 3NY 0.8857
361 4ZA 0.8857
362 1L5 0.8857
363 K97 0.8857
364 3OM 0.8855
365 R9J 0.8854
366 ESP 0.8854
367 JFM 0.8853
368 2D8 0.8853
369 FB2 0.8851
370 R2P 0.8850
371 GRQ 0.8850
372 6JN 0.8849
373 8NB 0.8849
374 ORN 0.8847
375 AEF 0.8847
376 S2P 0.8846
377 GLY GLY GLY 0.8846
378 6C5 0.8845
379 MED 0.8845
380 8K2 0.8845
381 BRH 0.8844
382 3A9 0.8844
383 S24 0.8842
384 L14 0.8841
385 OW7 0.8841
386 JB8 0.8837
387 HX4 0.8836
388 PHB 0.8835
389 A3M 0.8835
390 OHJ 0.8835
391 492 0.8833
392 RNO 0.8833
393 MAH 0.8832
394 DHS 0.8831
395 DTR 0.8831
396 GVA 0.8830
397 1N5 0.8830
398 K4V 0.8829
399 6XA 0.8829
400 HSO 0.8828
401 B40 0.8828
402 2UB 0.8827
403 FZM 0.8826
404 IXW 0.8825
405 DLT 0.8825
406 PBN 0.8825
407 LTT 0.8824
408 4FA 0.8824
409 NLQ 0.8823
410 LNR 0.8822
411 6KT 0.8821
412 2O6 0.8819
413 DI6 0.8818
414 5XC 0.8817
415 MHN 0.8815
416 0A1 0.8815
417 ABI 0.8814
418 PHI 0.8814
419 MEQ 0.8814
420 2O8 0.8813
421 KVP 0.8813
422 LPK 0.8812
423 MRU 0.8811
424 3HG 0.8811
425 ZZU 0.8809
426 HPN 0.8809
427 I2E 0.8809
428 PEQ 0.8809
429 ARG 0.8809
430 IWT 0.8808
431 ALA ALA 0.8807
432 PDC 0.8807
433 TZM 0.8806
434 52C 0.8806
435 PLP 0.8805
436 IVL 0.8805
437 MLZ 0.8804
438 DII 0.8804
439 5NI 0.8804
440 OTR 0.8804
441 GF4 0.8803
442 HWD 0.8803
443 NFM 0.8803
444 JDN 0.8802
445 BNL 0.8802
446 SYM 0.8802
447 I38 0.8801
448 LO1 0.8800
449 RNS 0.8800
450 3HP 0.8800
451 41K 0.8798
452 PAB 0.8798
453 JAW 0.8797
454 F06 0.8797
455 YIE 0.8797
456 258 0.8796
457 PD2 0.8795
458 26P 0.8794
459 OMD 0.8794
460 TMG 0.8792
461 FOC 0.8792
462 4NB 0.8791
463 PAC 0.8791
464 HXY 0.8791
465 DYT 0.8791
466 4P5 0.8789
467 NPO 0.8788
468 SNO 0.8788
469 PJL 0.8788
470 YOF 0.8788
471 RD4 0.8787
472 KVV 0.8787
473 AG2 0.8785
474 DAR 0.8784
475 363 0.8784
476 AC6 0.8782
477 F4E 0.8781
478 NAG 0.8781
479 MQB 0.8780
480 KTW 0.8780
481 P80 0.8778
482 OAA 0.8777
483 QIV 0.8777
484 RA7 0.8777
485 IOP 0.8776
486 PIM 0.8776
487 CSN 0.8774
488 YPN 0.8774
489 NPI 0.8774
490 DAH 0.8774
491 X1P 0.8773
492 5WZ 0.8771
493 IS2 0.8771
494 S7J 0.8771
495 4FE 0.8770
496 9BF 0.8769
497 NVU 0.8768
498 PBZ 0.8766
499 428 0.8766
500 8EW 0.8766
501 HL4 0.8766
502 ESI 0.8764
503 NM2 0.8763
504 3VS 0.8763
505 RNT 0.8761
506 GZ3 0.8760
507 LR5 0.8759
508 HNK 0.8757
509 GJZ 0.8756
510 KTJ 0.8756
511 F52 0.8756
512 M3P 0.8756
513 ASP 0.8754
514 M5H 0.8754
515 HL5 0.8754
516 EQW 0.8754
517 SHI 0.8753
518 KMT 0.8751
519 505 0.8747
520 TEG 0.8747
521 4NM 0.8746
522 LDP 0.8746
523 N6C 0.8745
524 LNO 0.8745
525 2F6 0.8745
526 YZM 0.8744
527 J9N 0.8743
528 KYN 0.8742
529 DE5 0.8742
530 SHV 0.8740
531 1Z6 0.8739
532 2FX 0.8739
533 6SD 0.8738
534 SWX 0.8737
535 CXH 0.8736
536 TU0 0.8736
537 7VP 0.8735
538 OQC 0.8734
539 K7M 0.8733
540 X1R 0.8733
541 HHI 0.8731
542 CUW 0.8730
543 YRL 0.8729
544 TRP 0.8729
545 I3E 0.8729
546 HNH 0.8728
547 HDH 0.8728
548 E3X 0.8728
549 15N 0.8728
550 C2Y 0.8728
551 CIR 0.8725
552 OKG 0.8724
553 2AL 0.8724
554 FF2 0.8724
555 9SE 0.8724
556 6ZX 0.8724
557 XOG 0.8723
558 5UK 0.8722
559 3AL 0.8721
560 97T 0.8721
561 M5E 0.8720
562 FV1 0.8718
563 L99 0.8718
564 173 0.8716
565 XXG 0.8716
566 86L 0.8716
567 PLP PMP 0.8716
568 LPB 0.8716
569 JAH 0.8714
570 HBD 0.8714
571 1A7 0.8713
572 3AE 0.8713
573 2HU 0.8712
574 J6W 0.8712
575 OHP 0.8712
576 CLU 0.8711
577 4MA 0.8711
578 GLY GLY 0.8709
579 P58 0.8708
580 4XS 0.8707
581 P4F 0.8703
582 4I8 0.8702
583 3SL 0.8702
584 PPR 0.8701
585 IYR 0.8698
586 APG 0.8698
587 ACA 0.8697
588 N4E 0.8697
589 LQ2 0.8697
590 2NP 0.8695
591 M45 0.8693
592 795 0.8691
593 HNL 0.8691
594 TT4 0.8690
595 MET 0.8690
596 3TC 0.8690
597 ONH 0.8690
598 FTV 0.8688
599 JRB 0.8687
600 J9Q 0.8686
601 MUC 0.8686
602 L22 0.8685
603 CLT 0.8682
604 GVG 0.8682
605 LT1 0.8681
606 4OG 0.8681
607 CIT 0.8680
608 XDK 0.8680
609 EOU 0.8679
610 N2M 0.8679
611 DVQ 0.8678
612 42J 0.8677
613 LY0 0.8677
614 E0O 0.8676
615 40F 0.8675
616 268 0.8674
617 KTA 0.8673
618 HAR 0.8673
619 SBK 0.8673
620 N7I 0.8672
621 LZ5 0.8672
622 FER 0.8671
623 D6P 0.8670
624 VFG 0.8669
625 DEW 0.8669
626 QBM 0.8669
627 56D 0.8666
628 RMN 0.8666
629 3QO 0.8665
630 DCZ 0.8664
631 P72 0.8663
632 MLT 0.8661
633 6HO 0.8659
634 QY9 0.8659
635 GJK 0.8658
636 4BZ 0.8657
637 ILO 0.8656
638 1Y6 0.8656
639 0JD 0.8655
640 PQK 0.8655
641 D6G 0.8654
642 XRS 0.8654
643 ICO 0.8652
644 QMS 0.8651
645 S8V 0.8650
646 C53 0.8648
647 449 0.8647
648 FPL 0.8645
649 6J5 0.8644
650 NYL 0.8642
651 RBL 0.8642
652 535 0.8642
653 ROR 0.8641
654 SDF 0.8640
655 QDK 0.8640
656 RJY 0.8638
657 3CR 0.8638
658 ODO 0.8637
659 23J 0.8636
660 SD4 0.8636
661 NCT 0.8634
662 3VW 0.8632
663 92P 0.8632
664 HJ7 0.8631
665 4XF 0.8629
666 GOJ 0.8628
667 Z82 0.8627
668 AMQ 0.8627
669 JF6 0.8626
670 AL0 0.8626
671 R1P 0.8626
672 S7G 0.8626
673 PGA 0.8624
674 JA5 0.8623
675 DUR 0.8623
676 JZA 0.8623
677 PSE 0.8623
678 M3Q 0.8617
679 N1E 0.8615
680 FP1 0.8613
681 9UL 0.8611
682 LMR 0.8609
683 IOM 0.8607
684 XX3 0.8606
685 1DV 0.8603
686 BPY 0.8603
687 BTM 0.8603
688 MJ5 0.8603
689 CH9 0.8602
690 LEU 0.8602
691 7WG 0.8599
692 9ZE 0.8598
693 M44 0.8598
694 46P 0.8597
695 EYJ 0.8595
696 9B3 0.8594
697 M6H 0.8594
698 G6P 0.8594
699 ASN 0.8594
700 Q07 0.8593
701 49F 0.8587
702 J4K 0.8586
703 X04 0.8585
704 YI6 0.8584
705 AAN 0.8580
706 3MF 0.8579
707 K82 0.8576
708 RB5 0.8575
709 9R5 0.8573
710 MNP 0.8571
711 3VX 0.8571
712 5XA 0.8570
713 N3W 0.8568
714 OEM 0.8568
715 8XL 0.8566
716 CH8 0.8563
717 1VK 0.8562
718 MEV 0.8562
719 AVI 0.8561
720 G14 0.8561
721 GO8 0.8561
722 I4B 0.8559
723 RKV 0.8559
724 N2Z 0.8558
725 NNO 0.8555
726 Y3L 0.8554
727 X0U 0.8553
728 BVA 0.8551
729 FHB 0.8550
730 KLS 0.8545
731 DE3 0.8542
732 NLA 0.8538
733 HA5 0.8536
734 XUL 0.8535
735 9RW 0.8532
736 4V2 0.8530
737 PMP 0.8529
738 54E 0.8527
739 463 0.8503
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 5XU2; Ligand: 8EL; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 1) in the query (biounit: 5xu2.bio1) has 35 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 5XU2; Ligand: 8EL; 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: 5xu2.bio1) has 35 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 5XU2; Ligand: TPP; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 3) in the query (biounit: 5xu2.bio1) has 35 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 5XU2; Ligand: TPP; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 4) in the query (biounit: 5xu2.bio1) has 35 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 5; Query (leader) PDB : 5XU2; Ligand: F6R; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 5) in the query (biounit: 5xu2.bio1) has 35 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 6; Query (leader) PDB : 5XU2; Ligand: F6R; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 6) in the query (biounit: 5xu2.bio1) has 35 residues
No: Leader PDB Ligand Sequence Similarity
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