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Receptor
PDB id Resolution Class Description Source Keywords
1UNB 1.5 Å EC: 1.14.20.1 DEACETOXYCEPHALOSPORIN C SYNTHASE COMPLEXED WITH 2-OXOGLUTAR AMPICILLIN STREPTOMYCES CLAVULIGERUS OXIDOREDUCTASE ANTIBIOTIC BIOSYNTHESIS
Ref.: THE STRUCTURAL BASIS OF CEPHALOSPORIN FORMATION IN MONONUCLEAR FERROUS ENZYME NAT.STRUCT.MOL.BIOL. V. 11 95 2004
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
AKG A:1311;
Valid;
none;
submit data
146.098 C5 H6 O5 C(CC(...
FE2 A:1310;
Part of Protein;
none;
submit data
55.845 Fe [Fe+2...
PN1 A:1312;
Valid;
none;
submit data
349.405 C16 H19 N3 O4 S CC1([...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1UNB 1.5 Å EC: 1.14.20.1 DEACETOXYCEPHALOSPORIN C SYNTHASE COMPLEXED WITH 2-OXOGLUTAR AMPICILLIN STREPTOMYCES CLAVULIGERUS OXIDOREDUCTASE ANTIBIOTIC BIOSYNTHESIS
Ref.: THE STRUCTURAL BASIS OF CEPHALOSPORIN FORMATION IN MONONUCLEAR FERROUS ENZYME NAT.STRUCT.MOL.BIOL. V. 11 95 2004
Members (9)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 1HJG - KIV C5 H8 O3 CC(C)C(=O)....
2 1UOG - P1C C14 H19 N3 O6 S CC1=C(N2[C....
3 1E5I - AKG C5 H6 O5 C(CC(=O)O)....
4 1HJF - COI C6 H10 O3 CC(C)CC(=O....
5 1UOF - PNN C16 H18 N2 O4 S CC1([C@@H]....
6 1UNB - PN1 C16 H19 N3 O4 S CC1([C@@H]....
7 1UOB - PNN C16 H18 N2 O4 S CC1([C@@H]....
8 1RXG - AKG C5 H6 O5 C(CC(=O)O)....
9 1UO9 - SIN C4 H6 O4 C(CC(=O)O)....
70% Homology Family (9)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 1HJG - KIV C5 H8 O3 CC(C)C(=O)....
2 1UOG - P1C C14 H19 N3 O6 S CC1=C(N2[C....
3 1E5I - AKG C5 H6 O5 C(CC(=O)O)....
4 1HJF - COI C6 H10 O3 CC(C)CC(=O....
5 1UOF - PNN C16 H18 N2 O4 S CC1([C@@H]....
6 1UNB - PN1 C16 H19 N3 O4 S CC1([C@@H]....
7 1UOB - PNN C16 H18 N2 O4 S CC1([C@@H]....
8 1RXG - AKG C5 H6 O5 C(CC(=O)O)....
9 1UO9 - SIN C4 H6 O4 C(CC(=O)O)....
50% Homology Family (9)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 1HJG - KIV C5 H8 O3 CC(C)C(=O)....
2 1UOG - P1C C14 H19 N3 O6 S CC1=C(N2[C....
3 1E5I - AKG C5 H6 O5 C(CC(=O)O)....
4 1HJF - COI C6 H10 O3 CC(C)CC(=O....
5 1UOF - PNN C16 H18 N2 O4 S CC1([C@@H]....
6 1UNB - PN1 C16 H19 N3 O4 S CC1([C@@H]....
7 1UOB - PNN C16 H18 N2 O4 S CC1([C@@H]....
8 1RXG - AKG C5 H6 O5 C(CC(=O)O)....
9 1UO9 - SIN C4 H6 O4 C(CC(=O)O)....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: AKG; Similar ligands found: 7
No: Ligand ECFP6 Tc MDL keys Tc
1 AKG 1 1
2 SIN 0.526316 0.833333
3 OOG 0.5 0.947368
4 69O 0.458333 0.714286
5 2IT 0.423077 0.615385
6 SHF 0.416667 0.666667
7 3PY 0.409091 0.652174
Ligand no: 2; Ligand: PN1; Similar ligands found: 6
No: Ligand ECFP6 Tc MDL keys Tc
1 PN1 1 1
2 AIC 1 1
3 PNN 0.565789 0.898305
4 IP1 0.5 0.84127
5 ZZ7 0.439024 0.803571
6 AIX 0.428571 0.818182
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1UNB; Ligand: PN1; Similar sites found with APoc: 479
This union binding pocket(no: 1) in the query (biounit: 1unb.bio1) has 32 residues
No: Leader PDB Ligand Sequence Similarity
1 3ZW2 GAL FUC None
2 3T2W BTN None
3 1WW5 SGA BGC None
4 1KGI T4A None
5 3ZW2 NAG GAL FUC None
6 1VYF OLA None
7 3ZW2 GLA NAG GAL FUC None
8 4CSD MFU 0.735294
9 4DOO DAO 0.97561
10 3AVR OGA 1.28617
11 6F6D AKG 1.28617
12 5FP3 3JI 1.28617
13 6FUL E7Z 1.28617
14 4UF0 MMK 1.28617
15 1Z03 OCH 1.28617
16 3HX3 RET 1.28617
17 4X5S AZM 1.2931
18 4L4J NAG NAG BMA MAN NAG 1.35747
19 5OF1 SAL 1.42857
20 1SLT NDG GAL 1.49254
21 5I0U DCY 1.5
22 5JWP AKG 1.60772
23 4B7E OGA 1.60772
24 1H2K OGA 1.60772
25 3P3N AKG 1.60772
26 1H2M OGA 1.60772
27 2Y0I AKG 1.60772
28 4CCK OGA 1.60772
29 4Y3O OGA 1.60772
30 2WA4 069 1.60772
31 4CCO OGA 1.60772
32 3MF2 AMP 1.60772
33 4W9N TCL 1.60772
34 4G7A AZM 1.6129
35 2QGI UDP 1.6129
36 5ZM4 AKG 1.63399
37 6GVZ CHO 1.63934
38 1QY1 PRZ 1.72414
39 5EPA AKG 1.79211
40 5EW9 5VC 1.84502
41 3N9P OGA 1.92926
42 3N9Q OGA 1.92926
43 3N9O OGA 1.92926
44 3PUR 2HG 1.92926
45 1R37 ETX 1.92926
46 5L2R MLA 1.92926
47 3ZDS HMQ 1.92926
48 4LS3 HIS 1.92926
49 3ZDS OMD 1.92926
50 4MZU TYD 1.92926
51 4HWT 1B2 1.92926
52 2C49 ADN 1.98676
53 3HAV SRY 2.00669
54 1DMY AZM 2.01613
55 3ACL 3F1 2.02703
56 3GLC R5P 2.0339
57 2BS5 BGC GAL FUC 2.22222
58 4NAE 1GP 2.22222
59 6F7X MFU 2.22222
60 2JIG PD2 2.23214
61 2X32 OTP 2.23464
62 4NAO AKG 2.2508
63 1ZDQ MSM 2.2508
64 3JU6 ANP 2.2508
65 1URX AAL GAL AAL GLA 2.2508
66 1U6R ADP 2.2508
67 4BG4 ADP 2.2508
68 3QSB 743 2.2508
69 2P7Q GG6 2.25564
70 1P19 IMP 2.26244
71 3HPY MCT 2.26537
72 3E8T UQ8 2.27273
73 1M3U KPL 2.27273
74 4QM9 CYS 2.31214
75 1ZP9 ATP 2.32558
76 1AUA BOG 2.36486
77 1OS7 TAU 2.4735
78 1OS7 AKG 2.4735
79 3SAO DBH 2.5
80 3SAO NKN 2.5
81 2WT9 NIO 2.55319
82 4MOB ADP 2.57235
83 3OPT AKG 2.57235
84 3JQ3 ADP 2.57235
85 5YBL AKG 2.57235
86 2VFT SOR 2.57235
87 5EO8 TFU 2.57235
88 5YJS SAL 2.57235
89 4CU7 GIF 2.57235
90 4IE6 UN9 2.57235
91 6F9G PUT 2.57235
92 4RYV ZEA 2.58065
93 3FW3 ETS 2.63158
94 1X9I G6Q 2.64901
95 2GC0 PAN 2.65957
96 2OVD DAO 2.74725
97 5V3D FCN 2.75862
98 2X34 UQ8 2.76243
99 5LOL GSH 2.7907
100 5I8T LAC 2.7933
101 3WG3 A2G GAL NAG FUC 2.80899
102 4N7C AEF 2.84091
103 4U0W 16G 2.84553
104 4BXF AKG 2.89389
105 5FWJ MMK 2.89389
106 5FP4 YC8 2.89389
107 5NW7 9C2 2.89389
108 1OFL NGK GCD 2.89389
109 4YVN EBS 2.89389
110 4QCK ASD 2.89389
111 3MA0 XYP 2.89389
112 4KYS VIB 2.89389
113 2R09 4IP 2.89389
114 2YG2 S1P 2.90698
115 6EOZ AKG 2.92208
116 6EOZ 58K 2.92208
117 2I6U NVA 2.9316
118 1NKI PPF 2.96296
119 2ET1 GLV 2.98507
120 4YGF AZM 2.99145
121 2UZ2 BTN 3.07692
122 1Y9Q MED 3.125
123 1GT4 UNA 3.14465
124 4MNS 2AX 3.14465
125 2HRL SIA GAL SIA BGC NGA CEQ 3.14961
126 5UC4 83S 3.18182
127 3KV5 OGA 3.21543
128 4M26 AKG 3.21543
129 4OOE FOM 3.21543
130 2OVW CBI 3.21543
131 3HKA FIX 3.21543
132 5Y4K AKR 3.21543
133 4JGP PYR 3.22581
134 2A1X AKG 3.24675
135 4TR9 38D 3.25203
136 2HFN FMN 3.26797
137 1NX4 AKG 3.2967
138 5V1B 8UY 3.33333
139 2GQR ADP 3.37553
140 2GQS C2R 3.37553
141 3WV6 GAL BGC 3.37838
142 3WV6 GAL GLC 3.37838
143 2HZQ STR 3.44828
144 1XE7 GUN 3.44828
145 5C5T AKG 3.50877
146 2P3V SRT 3.51562
147 6F4T OGA 3.52941
148 3RGA LSB 3.53357
149 2OG7 SIN 3.53698
150 4D4U FUC GAL NDG FUC 3.53698
151 5EVY SAL 3.53698
152 1VRP ADP 3.53698
153 3FW9 SLX 3.53698
154 4KBA 1QM 3.53698
155 4D4U FUC NDG GAL FUC 3.53698
156 4D4U FUC GAL 3.53698
157 4D4U FUC GAL NAG 3.53698
158 4D4U FUC 3.53698
159 4UOZ GLA 3.53698
160 5FPX GLY SER SER HIS HIS HIS HIS HIS 3.53982
161 2ZSC BTN 3.5461
162 5U9J GER 3.5503
163 1N5S ADL 3.57143
164 4H6B 10X 3.58974
165 4H6B 10Y 3.58974
166 5D3X 4IP 3.59281
167 4NPL AKG 3.6
168 5MJA 7O3 3.60656
169 1OIK AKG 3.65448
170 1OIJ AKG 3.65448
171 1OIK C26 3.65448
172 3MPB FRU 3.65854
173 1A78 TDG 3.73134
174 1KQW RTL 3.73134
175 5KWY C3S 3.7594
176 4P7X AKG 3.76712
177 4P7X YCP 3.76712
178 5F6U 5VK 3.82166
179 1DZT ATY 3.82514
180 2HKA C3S 3.84615
181 5HWV MBN 3.84615
182 2FCU AKG 3.85852
183 5FWE OGA 3.85852
184 2YBP 2HG 3.85852
185 5LY2 OGA 3.85852
186 2Q8E OGA 3.85852
187 2OS2 OGA 3.85852
188 6H8P OGA 3.85852
189 5YBN AKG 3.85852
190 2I56 RNS 3.85852
191 5KR7 6X9 3.85852
192 3GJB AKG 3.85852
193 5F3I 5UJ 3.85852
194 3B6R ADP 3.85852
195 5KJW 53C 3.85852
196 5FPE 3TR 3.85852
197 2RJH DCS 3.85852
198 5LY1 PPI 3.85852
199 3U6W KIV 3.85852
200 1C9K 5GP 3.88889
201 2C1Q BTN 3.96825
202 3MTX PGT 3.97351
203 4YBN FAD 4.01786
204 2XMY CDK 4.02685
205 1Y7P RIP 4.03587
206 4COQ SAN 4.04858
207 5M0T AKG 4.08163
208 1W3T 3GR 4.08163
209 4WUJ FMN 4.08163
210 4ZSI GLP 4.09357
211 4ZSI 4R1 4.09357
212 5HV0 AKG 4.14747
213 3PUA OGA 4.18006
214 2PNC CLU 4.18006
215 6F6J CUW 4.18006
216 6E08 NAP 4.18006
217 6F6J SIN 4.18006
218 1GQG DCD 4.18006
219 1WLE SRP 4.18006
220 3EQO LGC 4.18006
221 1ZPD CIT 4.18006
222 5HMR FDZ 4.19847
223 2FUE M1P 4.19847
224 2AG4 LP3 4.26829
225 2AG4 OLA 4.26829
226 1LRH NLA 4.29448
227 4IEN GDP 4.29448
228 4FE2 AIR 4.31373
229 6A63 LAT 4.34783
230 4JH6 FCN 4.34783
231 1O68 KIV 4.36364
232 3VV1 GAL FUC 4.375
233 1C1L GAL BGC 4.37956
234 3GM5 CIT 4.40252
235 3AJH BL3 4.43548
236 3N0Y APC 4.46927
237 2XUM OGA 4.50161
238 5YW0 SIN 4.50161
239 4QDC ASD 4.50161
240 3ZGJ RMN 4.50161
241 1VJ7 GPX 4.50161
242 4WOE ADP 4.50161
243 6HDT BTN 4.51128
244 2RDQ AKG 4.51389
245 5BVB DOG 4.54545
246 1P0Z FLC 4.58015
247 6EWZ APC 4.64135
248 2MJP ANP 4.66321
249 5TFZ 7BC 4.66667
250 4XAC AKG 4.7619
251 4ZXA H8N 4.7619
252 5XEG AKG 4.7619
253 5KBE IPH 4.80349
254 5WBF LAC 4.81482
255 6FXR AKG 4.82315
256 3NNF AKG 4.82315
257 1IGW PYR 4.82315
258 5JJU AMP 4.82315
259 3MI3 LYS 4.82315
260 3VMG 9CA 4.82315
261 4DA5 0H7 4.82315
262 5NCJ SIN 4.85075
263 5NCJ HL5 4.85075
264 2R0H CTO 4.87805
265 2AGC DAO 4.93827
266 5JSP DQY 4.97512
267 5N0L ILE 5.03145
268 5NLD LBT 5.03597
269 2IUW AKG 5.04202
270 6CC0 EWM 5.06329
271 3NV3 GAL NAG MAN 5.07246
272 6FOF LAT 5.10204
273 4J8T DOG 5.10949
274 5NFB 8VT 5.11364
275 5X7Q ACR 5.14469
276 4QDF 30Q 5.14469
277 5NBP BGC BGC BGC 5.14706
278 1J3R 6PG 5.26316
279 3W68 VIV 5.26316
280 2WBP ZZU 5.30726
281 2WBP SIN 5.30726
282 5KEW 6SB 5.31915
283 1ULE GLA GAL NAG 5.33333
284 4XCB HY0 5.36398
285 4XCB AKG 5.36398
286 2YMZ LAT 5.38462
287 1ZM1 BGC BGC BGC 5.39419
288 4ZU4 4TG 5.40541
289 4OCT AKG 5.40541
290 4IGQ OGA 5.46624
291 3RWP ABQ 5.46624
292 4IGQ THR M3L GLN 5.46624
293 2XZ9 PYR 5.46624
294 2VDF OCT 5.5336
295 6GW4 CHO 5.53746
296 5L9V OGA 5.55556
297 5OX6 A1Z 5.55556
298 5L9B AKG 5.55556
299 4USF 6UI 5.59211
300 1TW4 CHD 5.6
301 2RDG NDG FUC SIA GAL 5.61225
302 1QKQ MAN 5.6338
303 2YKL NLD 5.66038
304 3HQR OGA 5.69106
305 1AXD GGL CYW GLY 5.74163
306 4RF7 ARG 5.78778
307 4LIT AKG 5.78778
308 3H9R TAK 5.78778
309 6EXF LYS 5.78778
310 3WUC GLC GAL 5.83942
311 3W21 AKG 5.86081
312 4YLZ LAT NAG GAL 5.88235
313 4JLS 3ZE 5.92105
314 6GIN IR2 5.98007
315 1GU3 BGC BGC BGC BGC BGC 6.04027
316 3CBC DBS 6.06061
317 5U98 1KX 6.06061
318 3HUJ AGH 6.06061
319 1NYW DAU 6.09137
320 2Z5Y HRM 6.10932
321 2NZ5 226 6.10932
322 4NRT 2NG 6.10932
323 4OJ8 2TQ 6.14334
324 4OJ8 AKG 6.14334
325 2QL9 CIT 6.18557
326 3A6T 8OG 6.20155
327 3WW2 SF6 6.25
328 3WW2 LPK 6.25
329 5H9P TD2 6.32911
330 5GLT BGC GAL NAG GAL 6.33803
331 4IAW LIZ 6.38298
332 5UQD AKG 6.43087
333 1LSH PLD 6.43087
334 3A16 PXO 6.43087
335 1OJK GLC BGC 6.43087
336 1OJJ GLC GAL 6.43087
337 3B1Q NOS 6.43087
338 4M8D 23J 6.46388
339 2Z77 HE7 6.47482
340 2Z77 NCA 6.47482
341 4JZR 4JR 6.48148
342 3VHH VHH 6.50407
343 3EW2 BTN 6.66667
344 4YEE 4CQ 6.66667
345 3BXO UPP 6.69456
346 3FW4 CAQ 6.74157
347 3KV4 OGA 6.75241
348 1OFZ FUC 6.75241
349 5IQT AKG 6.75241
350 5IQT 6CU 6.75241
351 2ZHL NAG GAL GAL NAG 6.75676
352 1CEB AMH 6.81818
353 1IGJ DGX 6.84932
354 5DYO FLU 6.88073
355 2E56 MYR 6.94444
356 1DZK PRZ 7.00637
357 6D6L FY4 7.05882
358 3RUG DB6 7.07071
359 5LUN ARG 7.07396
360 5LUN OGA 7.07396
361 4BG1 OGA 7.07396
362 4BG1 IVL 7.07396
363 5H9Q TD2 7.09677
364 5IXG OTP 7.10059
365 6CAY ERG 7.10059
366 6CZI 38E 7.14286
367 3K4Z CBI 7.26644
368 4H2V AMP 7.27273
369 3L5R 47X 7.37705
370 1F9V ADP 7.3955
371 5YRV 5AD 7.3955
372 4BPZ GLC BGC BGC 7.42188
373 5TZO 7V7 7.44681
374 3OYW TDG 7.46269
375 1GZW GAL BGC 7.46269
376 6GR0 F8W 7.47126
377 5XQW 8EU 7.58294
378 4XMF HSM 7.6087
379 5VNF VAL THR SER VAL VAL 7.64331
380 5B09 4MX 7.69231
381 5TBM 79A 7.69231
382 5W10 CMP 7.69231
383 1YKD CMP 7.71704
384 3B00 16A 7.72059
385 5FRE SIA GAL 7.73196
386 2GJ5 VD3 8.02469
387 5OO5 UUA 8.06452
388 3E2M E2M 8.10811
389 1IS3 LAT 8.14815
390 4F7E 0SH 8.16327
391 3ZXE PGZ 8.27068
392 4WVW SLT 8.33333
393 4RFR RHN 8.37438
394 1U0A BGC BGC BGC BGC 8.41121
395 4Y24 TD2 8.44156
396 2VQ5 HBA 8.45771
397 5EQU AKG 8.52459
398 3VSV XYP 8.68167
399 3M3E GAL A2G NPO 8.69565
400 4JNJ BTN 8.69565
401 4H2W 5GP 8.73786
402 4RLT FSE 8.84354
403 4Z28 BTN 8.95522
404 5BVS EIC 9.09091
405 5EPQ OLA 9.14634
406 6D61 4AA 9.23077
407 1WBI BTN 9.30233
408 1Y52 BTN 9.52381
409 3BRN SRO 9.55414
410 3TAY MN0 9.81595
411 6BHQ NAG NAG FUL BMA MAN MAN NAG GAL 9.82143
412 6BYM HC3 9.85222
413 4WO4 JLS 10
414 5HA0 LTD 10.2564
415 3H7J PPY 10.2881
416 3H9A PPY 10.2881
417 1W6P NDG GAL 10.4478
418 1W6O LAT 10.4478
419 5TPV TYD 10.4575
420 1Y2F WAI 10.7914
421 4K55 H6P 11.2903
422 4CCN OGA 11.4286
423 4M1U A2G MBG 11.4286
424 4JX1 CAH 11.5044
425 5TPU TYD 11.5108
426 3KFF XBT 11.7284
427 3KFF ZBT 11.7284
428 3WUD GLC GAL 11.7647
429 3QUG GIX 11.9048
430 4BJ8 BTN 11.9048
431 2I5F 5IP 11.9266
432 2D6M LBT 11.9497
433 4BCS BTN 12
434 5AIG VPR 12
435 4D06 NAR 12.0141
436 4D52 GIV 12.2186
437 4D52 GXL 12.2186
438 4MLO PAM 12.3188
439 2XOM GAL GAL GAL 12.5
440 3ZO7 K6H 12.766
441 3I8T LBT 12.8049
442 2ARC ARA 12.8049
443 5N2D 8J8 13.1944
444 6GNO XDI 13.3333
445 4RD0 GDP 13.5048
446 4J25 OGA 13.5371
447 2ZMF CMP 13.7566
448 5W0N UPU 13.8264
449 5O9W AKG 14.791
450 5OCG 9R5 14.8148
451 2VWA PTY 14.8515
452 4EKV BTN 15.0943
453 4OB0 PBC 15.2381
454 5N2F 8HW 15.3226
455 4WN5 MVC 15.6522
456 3NZ1 3NY 16.092
457 6FA4 D1W 16.185
458 1SDW IYT 16.3987
459 4QYN RTL 16.5414
460 1QIN GIP 16.9399
461 5K21 6QF 17.7305
462 5ACM MBT 18.018
463 4GGZ BTN 18.2609
464 1OPB RET 18.6567
465 1SWG BTN 18.75
466 6FWH 5LD 19.2893
467 6BU0 IHP 19.8473
468 1ODM ASV 20.5788
469 1FHW I5P 20.9302
470 5FU3 BGC BGC BGC 23.5849
471 5T7I LAT NAG GAL 25.1613
472 2P5B OGA 31.8182
473 5DG2 GAL GLC 31.8519
474 5C3R HMU 32.7974
475 5C3R AKG 32.7974
476 4QXB OGA 33.3333
477 1GP6 QUE 34.4051
478 1GP6 SIN 34.4051
479 1GP6 DH2 34.4051
Pocket No.: 2; Query (leader) PDB : 1UNB; Ligand: PN1; 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: 1unb.bio1) has 32 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 1UNB; Ligand: PN1; 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: 1unb.bio1) has 32 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 1UNB; Ligand: AKG; Similar sites found with APoc: 482
This union binding pocket(no: 4) in the query (biounit: 1unb.bio1) has 30 residues
No: Leader PDB Ligand Sequence Similarity
1 3ZW2 GAL FUC None
2 3T2W BTN None
3 1WW5 SGA BGC None
4 1KGI T4A None
5 3ZW2 NAG GAL FUC None
6 1VYF OLA None
7 4CSD MFU 0.735294
8 4DOO DAO 0.97561
9 3AVR OGA 1.28617
10 6F6D AKG 1.28617
11 5FP3 3JI 1.28617
12 2NZ2 CIR 1.28617
13 4UF0 MMK 1.28617
14 1Z03 OCH 1.28617
15 3HX3 RET 1.28617
16 6FUL E7Z 1.28617
17 4X5S AZM 1.2931
18 4L4J NAG NAG BMA MAN NAG 1.35747
19 5OF1 SAL 1.42857
20 1SLT NDG GAL 1.49254
21 5I0U DCY 1.5
22 1Y0G 8PP 1.57068
23 5JWP AKG 1.60772
24 4B7E OGA 1.60772
25 1H2K OGA 1.60772
26 3P3N AKG 1.60772
27 1H2M OGA 1.60772
28 2Y0I AKG 1.60772
29 4CCK OGA 1.60772
30 4Y3O OGA 1.60772
31 2WA4 069 1.60772
32 4CCO OGA 1.60772
33 5G48 1FL 1.60772
34 3MF2 AMP 1.60772
35 4W9N TCL 1.60772
36 4G7A AZM 1.6129
37 2QGI UDP 1.6129
38 5ZM4 AKG 1.63399
39 1I06 TZL 1.66667
40 1QY1 PRZ 1.72414
41 5EPA AKG 1.79211
42 5EW9 5VC 1.84502
43 5H2U 1N1 1.87266
44 3E85 BSU 1.89873
45 5A89 FMN 1.92308
46 3N9P OGA 1.92926
47 3N9Q OGA 1.92926
48 3N9O OGA 1.92926
49 3PUR 2HG 1.92926
50 5L2R MLA 1.92926
51 3WXL ADP 1.92926
52 3ZDS HMQ 1.92926
53 4LS3 HIS 1.92926
54 3ZDS OMD 1.92926
55 4MZU TYD 1.92926
56 4HWT 1B2 1.92926
57 2C49 ADN 1.98676
58 3HAV SRY 2.00669
59 1DMY AZM 2.01613
60 3ACL 3F1 2.02703
61 3GLC R5P 2.0339
62 3ZJX BOG 2.07612
63 6MB9 NMY 2.18978
64 2BS5 BGC GAL FUC 2.22222
65 4NAE 1GP 2.22222
66 6F7X MFU 2.22222
67 2JIG PD2 2.23214
68 2X32 OTP 2.23464
69 4NAO AKG 2.2508
70 1ZDQ MSM 2.2508
71 3JU6 ANP 2.2508
72 1ELI PYC 2.2508
73 1URX AAL GAL AAL GLA 2.2508
74 5W75 SUC 2.2508
75 4BG4 ADP 2.2508
76 1U6R ADP 2.2508
77 3QSB 743 2.2508
78 2P7Q GG6 2.25564
79 1P19 IMP 2.26244
80 3E8T UQ8 2.27273
81 1M3U KPL 2.27273
82 4QM9 CYS 2.31214
83 1ZP9 ATP 2.32558
84 1F5F DHT 2.43902
85 1OS7 AKG 2.4735
86 1OS7 TAU 2.4735
87 3SAO DBH 2.5
88 3SAO NKN 2.5
89 2WT9 NIO 2.55319
90 4MOB ADP 2.57235
91 3OPT AKG 2.57235
92 3JQ3 ADP 2.57235
93 5YBL AKG 2.57235
94 2VFT SOR 2.57235
95 4IE6 UN9 2.57235
96 5EO8 TFU 2.57235
97 5YJS SAL 2.57235
98 4CU7 GIF 2.57235
99 6AC9 ANP 2.57235
100 6F9G PUT 2.57235
101 5IVE 6E8 2.57235
102 4RYV ZEA 2.58065
103 3FW3 ETS 2.63158
104 2GC0 PAN 2.65957
105 2OVD DAO 2.74725
106 2X34 UQ8 2.76243
107 5LOL GSH 2.7907
108 5I8T LAC 2.7933
109 3WG3 A2G GAL NAG FUC 2.80899
110 4BXF AKG 2.89389
111 5FWJ MMK 2.89389
112 5FP4 YC8 2.89389
113 5NW7 9C2 2.89389
114 1YFS ALA 2.89389
115 1I1E DM2 2.89389
116 4QCK ASD 2.89389
117 2R09 4IP 2.89389
118 4J6C STR 2.89389
119 2YG2 S1P 2.90698
120 6EOZ AKG 2.92208
121 6EOZ 58K 2.92208
122 2I6U NVA 2.9316
123 2ET1 GLV 2.98507
124 4YGF AZM 2.99145
125 2UZ2 BTN 3.07692
126 1Y9Q MED 3.125
127 4MNS 2AX 3.14465
128 1GT4 UNA 3.14465
129 2HRL SIA GAL SIA BGC NGA CEQ 3.14961
130 5UC4 83S 3.18182
131 3JQM GTP 3.18471
132 3KV5 OGA 3.21543
133 4M26 AKG 3.21543
134 4OOE FOM 3.21543
135 2MPR BGC GLC GLC 3.21543
136 5Y4K AKR 3.21543
137 2OVW CBI 3.21543
138 4JGP PYR 3.22581
139 2A1X AKG 3.24675
140 4TR9 38D 3.25203
141 1NX4 AKG 3.2967
142 5V1B 8UY 3.33333
143 2GQS C2R 3.37553
144 2GQR ADP 3.37553
145 3WV6 GAL BGC 3.37838
146 3WV6 GAL GLC 3.37838
147 1ZNY GDP 3.38164
148 5DNL 5DL 3.40909
149 2HZQ STR 3.44828
150 1XE7 GUN 3.44828
151 4ZU5 THM 3.47222
152 4QA8 PJZ 3.49345
153 5C5T AKG 3.50877
154 2P3V SRT 3.51562
155 6F4T OGA 3.52941
156 3RGA LSB 3.53357
157 2OG7 SIN 3.53698
158 5EVY SAL 3.53698
159 1VRP ADP 3.53698
160 3FW9 SLX 3.53698
161 4D4U FUC NDG GAL FUC 3.53698
162 4KBA 1QM 3.53698
163 4D4U FUC GAL 3.53698
164 4D4U FUC GAL NAG 3.53698
165 4D4U FUC 3.53698
166 4UOZ GLA 3.53698
167 5FPX GLY SER SER HIS HIS HIS HIS HIS 3.53982
168 2ZSC BTN 3.5461
169 1N5S ADL 3.57143
170 4H6B 10X 3.58974
171 4H6B 10Y 3.58974
172 5D3X 4IP 3.59281
173 4NPL AKG 3.6
174 1OIK AKG 3.65448
175 1OIJ AKG 3.65448
176 1OIK C26 3.65448
177 3MPB FRU 3.65854
178 1A78 TDG 3.73134
179 1KQW RTL 3.73134
180 5KWY C3S 3.7594
181 4P7X YCP 3.76712
182 4P7X AKG 3.76712
183 5F6U 5VK 3.82166
184 1DZT ATY 3.82514
185 2HKA C3S 3.84615
186 5HWV MBN 3.84615
187 2FCU AKG 3.85852
188 5FWE OGA 3.85852
189 2YBP 2HG 3.85852
190 5LY2 OGA 3.85852
191 2Q8E OGA 3.85852
192 2OS2 OGA 3.85852
193 6H8P OGA 3.85852
194 5YBN AKG 3.85852
195 5F3I 5UJ 3.85852
196 2I56 RNS 3.85852
197 5KR7 6X9 3.85852
198 3GJB AKG 3.85852
199 5LY1 PPI 3.85852
200 3B6R ADP 3.85852
201 5KJW 53C 3.85852
202 2RJH DCS 3.85852
203 3U6W KIV 3.85852
204 4XDA RIB 3.8835
205 5KO1 6UY 3.88693
206 1C9K 5GP 3.88889
207 1KZN CBN 3.90244
208 2C1Q BTN 3.96825
209 3MTX PGT 3.97351
210 2PFZ PCA 3.98671
211 4YBN FAD 4.01786
212 2XMY CDK 4.02685
213 1Y7P RIP 4.03587
214 4COQ SAN 4.04858
215 5M0T AKG 4.08163
216 1W3T 3GR 4.08163
217 4WUJ FMN 4.08163
218 4ZSI GLP 4.09357
219 4ZSI 4R1 4.09357
220 5HV0 AKG 4.14747
221 3PUA OGA 4.18006
222 2PNC CLU 4.18006
223 6F6J CUW 4.18006
224 6E08 NAP 4.18006
225 6F6J SIN 4.18006
226 1GQG DCD 4.18006
227 1WLE SRP 4.18006
228 3EQO LGC 4.18006
229 1ZPD CIT 4.18006
230 5M60 BGC 4.18006
231 2FUE M1P 4.19847
232 2AG4 OLA 4.26829
233 2AG4 LP3 4.26829
234 1LRH NLA 4.29448
235 4IEN GDP 4.29448
236 4FE2 AIR 4.31373
237 6A63 LAT 4.34783
238 4JH6 FCN 4.34783
239 1O68 KIV 4.36364
240 3VV1 GAL FUC 4.375
241 1C1L GAL BGC 4.37956
242 3GM5 CIT 4.40252
243 3AJH BL3 4.43548
244 3QRC SCR 4.4586
245 3N0Y APC 4.46927
246 2XUM OGA 4.50161
247 5YW0 SIN 4.50161
248 4QDC ASD 4.50161
249 4WOE ADP 4.50161
250 6HDT BTN 4.51128
251 2RDQ AKG 4.51389
252 5BVB DOG 4.54545
253 1P0Z FLC 4.58015
254 6EWZ APC 4.64135
255 2MJP ANP 4.66321
256 5TFZ 7BC 4.66667
257 4XAC AKG 4.7619
258 4ZXA H8N 4.7619
259 5XEG AKG 4.7619
260 5KBE IPH 4.80349
261 5WBF LAC 4.81482
262 6FXR AKG 4.82315
263 3NNF AKG 4.82315
264 1IGW PYR 4.82315
265 5JJU AMP 4.82315
266 3MI3 LYS 4.82315
267 4DA5 0H7 4.82315
268 5NCJ SIN 4.85075
269 5NCJ HL5 4.85075
270 2R0H CTO 4.87805
271 2AGC DAO 4.93827
272 5JSP DQY 4.97512
273 5N0L ILE 5.03145
274 5NLD LBT 5.03597
275 2IUW AKG 5.04202
276 6CC0 EWM 5.06329
277 3NV3 GAL NAG MAN 5.07246
278 6FOF LAT 5.10204
279 4J8T DOG 5.10949
280 5NFB 8VT 5.11364
281 5X7Q ACR 5.14469
282 5X7Q GLC GLC GLC GLC GLC 5.14469
283 4QDF 30Q 5.14469
284 5NBP BGC BGC BGC 5.14706
285 1J3R 6PG 5.26316
286 3W68 VIV 5.26316
287 2WBP ZZU 5.30726
288 2WBP SIN 5.30726
289 5KEW 6SB 5.31915
290 1ULE GLA GAL NAG 5.33333
291 4XCB HY0 5.36398
292 4XCB AKG 5.36398
293 2YMZ LAT 5.38462
294 1ZM1 BGC BGC BGC 5.39419
295 4ZU4 4TG 5.40541
296 4OCT AKG 5.40541
297 4IGQ OGA 5.46624
298 3RWP ABQ 5.46624
299 4IGQ THR M3L GLN 5.46624
300 2XZ9 PYR 5.46624
301 2VDF OCT 5.5336
302 6GW4 CHO 5.53746
303 5L9V OGA 5.55556
304 5OX6 A1Z 5.55556
305 5L9B AKG 5.55556
306 4USF 6UI 5.59211
307 1TW4 CHD 5.6
308 2RDG NDG FUC SIA GAL 5.61225
309 1QKQ MAN 5.6338
310 2YKL NLD 5.66038
311 1SU2 ATP 5.66038
312 3HQR OGA 5.69106
313 1AXD GGL CYW GLY 5.74163
314 4RF7 ARG 5.78778
315 4LIT AKG 5.78778
316 6EXF LYS 5.78778
317 3WUC GLC GAL 5.83942
318 3W21 AKG 5.86081
319 4YLZ LAT NAG GAL 5.88235
320 6GIN IR2 5.98007
321 1GU3 BGC BGC BGC BGC BGC 6.04027
322 3CBC DBS 6.06061
323 5U98 1KX 6.06061
324 3STK PLM 6.06061
325 1NYW DAU 6.09137
326 2Z5Y HRM 6.10932
327 2NZ5 226 6.10932
328 4NRT 2NG 6.10932
329 4OJ8 AKG 6.14334
330 4OJ8 2TQ 6.14334
331 2QL9 CIT 6.18557
332 3A6T 8OG 6.20155
333 3WW2 SF6 6.25
334 5H9P TD2 6.32911
335 5GLT BGC GAL NAG GAL 6.33803
336 4IAW LIZ 6.38298
337 5UQD AKG 6.43087
338 1LSH PLD 6.43087
339 3A16 PXO 6.43087
340 1OJK GLC BGC 6.43087
341 1OJJ GLC GAL 6.43087
342 3B1Q NOS 6.43087
343 4M8D 23J 6.46388
344 2Z77 HE7 6.47482
345 4JZR 4JR 6.48148
346 3VHH VHH 6.50407
347 6MPT C30 6.64336
348 3EW2 BTN 6.66667
349 4YEE 4CQ 6.66667
350 3BXO UPP 6.69456
351 3KV4 OGA 6.75241
352 1OFZ FUC 6.75241
353 5IQT AKG 6.75241
354 5IQT 6CU 6.75241
355 2ZHL NAG GAL GAL NAG 6.75676
356 1CEB AMH 6.81818
357 1IGJ DGX 6.84932
358 2E56 MYR 6.94444
359 1DZK PRZ 7.00637
360 6D6L FY4 7.05882
361 3G08 FEE 7.07071
362 3RUG DB6 7.07071
363 5LUN ARG 7.07396
364 5LUN OGA 7.07396
365 4BG1 IVL 7.07396
366 4BG1 OGA 7.07396
367 5H9Q TD2 7.09677
368 5IXG OTP 7.10059
369 6CAY ERG 7.10059
370 6CZI 38E 7.14286
371 3K4Z CBI 7.26644
372 4H2V AMP 7.27273
373 3L5R 47X 7.37705
374 1F9V ADP 7.3955
375 5YRV 5AD 7.3955
376 4BPZ GLC BGC BGC 7.42188
377 5TZO 7V7 7.44681
378 3OYW TDG 7.46269
379 1GZW GAL BGC 7.46269
380 6GR0 F8W 7.47126
381 3SCH TB6 7.57576
382 5XQW 8EU 7.58294
383 4XMF HSM 7.6087
384 5VNF VAL THR SER VAL VAL 7.64331
385 5B09 4MX 7.69231
386 5TBM 79A 7.69231
387 1YKD CMP 7.71704
388 4KTP BGC 7.71704
389 3B00 16A 7.72059
390 5FRE SIA GAL 7.73196
391 2GJ5 VD3 8.02469
392 3E2M E2M 8.10811
393 1IS3 LAT 8.14815
394 4F7E 0SH 8.16327
395 3L9R L9R 8.16327
396 3ZXE PGZ 8.27068
397 4WVW SLT 8.33333
398 4RFR RHN 8.37438
399 1U0A BGC BGC BGC BGC 8.41121
400 4Y24 TD2 8.44156
401 2VQ5 HBA 8.45771
402 5EQU AKG 8.52459
403 3VSV XYP 8.68167
404 3M3E GAL A2G NPO 8.69565
405 4JNJ BTN 8.69565
406 4H2X G5A 8.73786
407 4H2W 5GP 8.73786
408 4RLT FSE 8.84354
409 4Z28 BTN 8.95522
410 5BVS EIC 9.09091
411 5EPQ OLA 9.14634
412 6D61 4AA 9.23077
413 1WBI BTN 9.30233
414 1Y52 BTN 9.52381
415 3BRN SRO 9.55414
416 3TAY MN0 9.81595
417 6BHQ NAG NAG FUL BMA MAN MAN NAG GAL 9.82143
418 6BYM HC3 9.85222
419 2NNQ T4B 9.92366
420 4WO4 JLS 10
421 5HA0 LTD 10.2564
422 3H9A PPY 10.2881
423 3H7J PPY 10.2881
424 1W6O LAT 10.4478
425 5TPV TYD 10.4575
426 1Y2F WAI 10.7914
427 4JN6 OXL 11.1111
428 4K55 H6P 11.2903
429 4CCN OGA 11.4286
430 4M1U A2G MBG 11.4286
431 5TPU TYD 11.5108
432 3KFF XBT 11.7284
433 3KFF ZBT 11.7284
434 3WUD GLC GAL 11.7647
435 4BJ8 BTN 11.9048
436 3QUG GIX 11.9048
437 2D6M LBT 11.9497
438 5BU3 4W9 11.9565
439 5AIG VPR 12
440 4D06 NAR 12.0141
441 4D52 GIV 12.2186
442 4D52 GXL 12.2186
443 4MLO PAM 12.3188
444 3VQ2 LP4 LP5 MYR DAO 12.5
445 2XOM GAL GAL GAL 12.5
446 3I8T LBT 12.8049
447 2ARC ARA 12.8049
448 6GNO XDI 13.3333
449 5ML3 DL3 13.4228
450 4RD0 GDP 13.5048
451 4J25 OGA 13.5371
452 2ZMF CMP 13.7566
453 5W0N UPU 13.8264
454 5O9W AKG 14.791
455 5OCG 9R5 14.8148
456 2VWA PTY 14.8515
457 4EKV BTN 15.0943
458 4OB0 PBC 15.2381
459 4WN5 MVC 15.6522
460 6FA4 D1W 16.185
461 1SDW IYT 16.3987
462 4QYN RTL 16.5414
463 1QIN GIP 16.9399
464 5K21 6QF 17.7305
465 5ACM MBT 18.018
466 4GGZ BTN 18.2609
467 1OPB RET 18.6567
468 1SWG BTN 18.75
469 6FWH 5LD 19.2893
470 6BU0 IHP 19.8473
471 1ODM ASV 20.5788
472 1FHW I5P 20.9302
473 5FU3 BGC BGC BGC 23.5849
474 5T7I LAT NAG GAL 25.1613
475 2P5B OGA 31.8182
476 5DG2 GAL GLC 31.8519
477 5C3R HMU 32.7974
478 5C3R AKG 32.7974
479 4QXB OGA 33.3333
480 1GP6 SIN 34.4051
481 1GP6 DH2 34.4051
482 1GP6 QUE 34.4051
Pocket No.: 5; Query (leader) PDB : 1UNB; Ligand: AKG; 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: 1unb.bio1) has 30 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 6; Query (leader) PDB : 1UNB; Ligand: AKG; 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: 1unb.bio1) has 30 residues
No: Leader PDB Ligand Sequence Similarity
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