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Receptor
PDB id Resolution Class Description Source Keywords
3HY2 2.1 Å EC: 1.11.1.15 CRYSTAL STRUCTURE OF SULFIREDOXIN IN COMPLEX WITH PEROXIREDO ATP:MG2+ HOMO SAPIENS PROTEIN-PROTEIN COMPLEX REDOX BIOLOGY PROTEIN REPAIR SULFCHEMISTRY ANTIOXIDANT DISULFIDE BOND OXIDOREDUCTASE PERPHOSPHOPROTEIN REDOX-ACTIVE CENTER ATP-BINDING MAGNESIUMNUCLEOTIDE-BINDING
Ref.: PROTEIN ENGINEERING OF THE QUATERNARY SULFIREDOXIN-PEROXIREDOXIN ENZYME-SUBSTRATE COMPLEX THE MOLECULAR BASIS FOR CYSTEINE SULFINIC ACID PHOSPHORYLATION J.BIOL.CHEM. V. 284 33305 2009
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ATP X:1;
Y:2;
Valid;
Valid;
none;
none;
submit data
507.181 C10 H16 N5 O13 P3 c1nc(...
MG A:207;
B:207;
Invalid;
Invalid;
none;
none;
submit data
24.305 Mg [Mg+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3HY2 2.1 Å EC: 1.11.1.15 CRYSTAL STRUCTURE OF SULFIREDOXIN IN COMPLEX WITH PEROXIREDO ATP:MG2+ HOMO SAPIENS PROTEIN-PROTEIN COMPLEX REDOX BIOLOGY PROTEIN REPAIR SULFCHEMISTRY ANTIOXIDANT DISULFIDE BOND OXIDOREDUCTASE PERPHOSPHOPROTEIN REDOX-ACTIVE CENTER ATP-BINDING MAGNESIUMNUCLEOTIDE-BINDING
Ref.: PROTEIN ENGINEERING OF THE QUATERNARY SULFIREDOXIN-PEROXIREDOXIN ENZYME-SUBSTRATE COMPLEX THE MOLECULAR BASIS FOR CYSTEINE SULFINIC ACID PHOSPHORYLATION J.BIOL.CHEM. V. 284 33305 2009
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 4 families.
1 3HY2 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 4 families.
1 3HY2 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 4 families.
1 3HY2 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: ATP; Similar ligands found: 422
No: Ligand ECFP6 Tc MDL keys Tc
1 HEJ 1 1
2 ATP 1 1
3 5FA 0.985507 1
4 AQP 0.985507 1
5 AP5 0.927536 0.971831
6 B4P 0.927536 0.971831
7 BA3 0.913043 0.971831
8 ADP 0.9 1
9 A2D 0.884058 0.971831
10 AGS 0.84 0.945946
11 SAP 0.84 0.945946
12 6YZ 0.833333 0.972222
13 AT4 0.810811 0.958904
14 AN2 0.810811 0.985915
15 25L 0.809524 0.985915
16 AR6 0.802632 0.971831
17 APR 0.802632 0.971831
18 M33 0.8 0.958333
19 ACQ 0.794872 0.972222
20 TAT 0.794872 0.958904
21 T99 0.794872 0.958904
22 AD9 0.792208 0.972222
23 ACP 0.789474 0.972222
24 AMP 0.788732 0.971429
25 A 0.788732 0.971429
26 ANP 0.772152 0.972222
27 CA0 0.753247 0.945205
28 ADX 0.753247 0.873418
29 A22 0.746988 0.985915
30 50T 0.74359 0.958333
31 PRX 0.734177 0.893333
32 APC 0.734177 0.958904
33 ABM 0.733333 0.917808
34 ATF 0.731707 0.958904
35 ITT 0.730769 0.943662
36 7D4 0.730769 0.905405
37 ADQ 0.729412 0.945205
38 A3R 0.729412 0.907895
39 AP2 0.714286 0.958904
40 A12 0.714286 0.958904
41 A1R 0.709302 0.907895
42 SRA 0.706667 0.918919
43 5AL 0.698795 0.931507
44 HFD 0.695122 0.945946
45 9X8 0.693182 0.92
46 OAD 0.693182 0.945205
47 AU1 0.6875 0.972222
48 SRP 0.682353 0.906667
49 G5P 0.680851 0.921053
50 25A 0.678161 0.971831
51 3OD 0.677778 0.945205
52 4AD 0.670455 0.92
53 G3A 0.670213 0.921053
54 00A 0.662921 0.883117
55 RBY 0.662651 0.932432
56 ADP PO3 0.662651 0.943662
57 ADV 0.662651 0.932432
58 BIS 0.659341 0.933333
59 8QN 0.659091 0.931507
60 5SV 0.659091 0.848101
61 OOB 0.659091 0.931507
62 GTA 0.65625 0.886076
63 UP5 0.653061 0.92
64 AMO 0.651685 0.932432
65 PAJ 0.651685 0.884615
66 2A5 0.650602 0.918919
67 MAP 0.647727 0.945946
68 3AT 0.647059 0.971831
69 AHX 0.644444 0.896104
70 DLL 0.644444 0.931507
71 ATR 0.642857 0.971429
72 PAP 0.642857 0.985714
73 PTJ 0.641304 0.896104
74 7D3 0.6375 0.905405
75 3UK 0.637363 0.918919
76 SON 0.634146 0.932432
77 A4P 0.633663 0.843373
78 ALF ADP 0.632184 0.87013
79 ADP ALF 0.632184 0.87013
80 PR8 0.630435 0.85
81 WAQ 0.630435 0.883117
82 LAD 0.630435 0.860759
83 B5V 0.630435 0.906667
84 AFH 0.628866 0.884615
85 LMS 0.628205 0.82716
86 GAP 0.627907 0.893333
87 DTP 0.627907 0.905405
88 VO4 ADP 0.625 0.931507
89 ADP VO4 0.625 0.931507
90 TXA 0.623656 0.932432
91 ME8 0.623656 0.839506
92 1ZZ 0.623656 0.839506
93 NB8 0.623656 0.896104
94 FYA 0.623656 0.905405
95 DQV 0.622449 0.958333
96 T5A 0.621359 0.841463
97 ADN 0.619718 0.84507
98 RAB 0.619718 0.84507
99 XYA 0.619718 0.84507
100 DAL AMP 0.611111 0.905405
101 9SN 0.610526 0.871795
102 48N 0.61 0.896104
103 AP0 0.607843 0.896104
104 9ZD 0.604396 0.907895
105 9ZA 0.604396 0.907895
106 FA5 0.604167 0.906667
107 B5M 0.604167 0.894737
108 YAP 0.604167 0.894737
109 B5Y 0.604167 0.894737
110 NAI 0.60396 0.907895
111 6V0 0.60396 0.896104
112 TXD 0.60396 0.907895
113 DND 0.60396 0.932432
114 NXX 0.60396 0.932432
115 NAX 0.60396 0.873418
116 ADP BMA 0.602151 0.918919
117 A2R 0.6 0.985915
118 OMR 0.598039 0.851852
119 TXE 0.598039 0.907895
120 XAH 0.597938 0.839506
121 7DT 0.593023 0.985714
122 AOC 0.592593 0.821918
123 4UV 0.591837 0.894737
124 DDS 0.590909 0.878378
125 139 0.590476 0.873418
126 CNA 0.584906 0.932432
127 6AD 0.58427 0.909091
128 5AS 0.583333 0.77907
129 5N5 0.581081 0.819444
130 GA7 0.58 0.906667
131 4UU 0.58 0.894737
132 4TC 0.576923 0.896104
133 ADJ 0.575472 0.851852
134 5CD 0.573333 0.805556
135 A4D 0.573333 0.819444
136 RGT 0.571429 0.958904
137 A3P 0.571429 0.971429
138 7D5 0.56962 0.878378
139 LAQ 0.568627 0.839506
140 F2R 0.564815 0.864198
141 80F 0.563636 0.841463
142 YLP 0.563107 0.819277
143 A A 0.5625 0.944444
144 UPA 0.561905 0.907895
145 AV2 0.56044 0.917808
146 COD 0.559633 0.811765
147 4UW 0.557692 0.860759
148 JB6 0.556701 0.883117
149 3AM 0.555556 0.929577
150 ATP A A A 0.555556 0.930556
151 A2P 0.552941 0.957143
152 TYM 0.552381 0.906667
153 NA7 0.552083 0.958904
154 EP4 0.551282 0.753247
155 MYR AMP 0.55102 0.817073
156 PPS 0.549451 0.873418
157 YLC 0.54717 0.839506
158 YLB 0.54717 0.819277
159 NAD 0.545455 0.931507
160 DAT 0.545455 0.905405
161 TYR AMP 0.544554 0.87013
162 G5A 0.544444 0.77907
163 M2T 0.544304 0.734177
164 DTA 0.544304 0.786667
165 3DH 0.54321 0.773333
166 128 0.542857 0.776471
167 AHZ 0.538462 0.817073
168 GTP 0.537634 0.92
169 SSA 0.537634 0.8
170 MTA 0.5375 0.773333
171 IOT 0.537037 0.831325
172 A3D 0.535714 0.918919
173 ARG AMP 0.533981 0.829268
174 7MD 0.533981 0.8625
175 AR6 AR6 0.533981 0.917808
176 YLA 0.53211 0.819277
177 AMP DBH 0.529412 0.893333
178 IMO 0.529412 0.929577
179 TAD 0.528846 0.884615
180 AYB 0.527273 0.809524
181 A5A 0.526882 0.807229
182 HDV 0.526882 0.893333
183 TSB 0.526316 0.819277
184 EAD 0.525424 0.873418
185 2AM 0.52439 0.943662
186 6RE 0.52381 0.759494
187 7DD 0.522727 0.985714
188 V3L 0.521739 0.971831
189 AVV 0.520833 0.896104
190 BTX 0.517857 0.841463
191 NAE 0.517241 0.894737
192 52H 0.515789 0.77907
193 54H 0.515789 0.788235
194 VMS 0.515789 0.788235
195 NSS 0.515464 0.8
196 BT5 0.513274 0.831325
197 NAQ 0.512821 0.871795
198 ZAS 0.511905 0.766234
199 J7C 0.511628 0.769231
200 A3N 0.511628 0.786667
201 5X8 0.511111 0.763158
202 53H 0.510417 0.77907
203 8X1 0.510417 0.752809
204 5CA 0.510417 0.8
205 NVA LMS 0.510204 0.752809
206 ARU 0.510204 0.860759
207 AF3 ADP 3PG 0.509259 0.8375
208 ZID 0.508475 0.918919
209 P1H 0.508197 0.851852
210 OVE 0.505882 0.905405
211 S4M 0.505747 0.666667
212 LEU LMS 0.50505 0.752809
213 LPA AMP 0.504673 0.817073
214 7MC 0.504587 0.841463
215 DZD 0.5 0.884615
216 FB0 0.5 0.804598
217 MAO 0.5 0.759036
218 DSZ 0.5 0.8
219 LSS 0.5 0.761364
220 DSH 0.5 0.725
221 P5A 0.5 0.744444
222 NDE 0.495935 0.932432
223 N0B 0.495798 0.819277
224 M24 0.495726 0.85
225 YLY 0.495726 0.809524
226 NJP 0.495575 0.945946
227 9K8 0.49505 0.714286
228 MGP 0.494737 0.884615
229 6C6 0.494624 0.881579
230 NAJ PZO 0.491379 0.848101
231 0WD 0.491228 0.921053
232 6G0 0.489583 0.884615
233 GJV 0.488636 0.75
234 6FA 0.488189 0.841463
235 5AD 0.486842 0.746479
236 KAA 0.485149 0.752809
237 GSU 0.485149 0.77907
238 71V 0.483146 0.907895
239 NEC 0.482759 0.746667
240 A3G 0.482759 0.8
241 ODP 0.482456 0.909091
242 FAS 0.48062 0.851852
243 FAD 0.48062 0.851852
244 7D7 0.480519 0.743243
245 FDA 0.480315 0.833333
246 N6P 0.48 0.915493
247 2SA 0.479167 0.932432
248 GP3 0.478723 0.921053
249 4TA 0.478261 0.807229
250 SFG 0.478261 0.75
251 G A A A 0.478261 0.871795
252 AMP NAD 0.478261 0.905405
253 NPW 0.477876 0.886076
254 NDP 0.477876 0.921053
255 NDC 0.47619 0.871795
256 YSA 0.47619 0.77907
257 NAJ PYZ 0.475 0.807229
258 MGO 0.474227 0.860759
259 GDP 0.473684 0.92
260 NZQ 0.473684 0.909091
261 TXP 0.473684 0.921053
262 6IA 0.473684 0.8375
263 A7D 0.472527 0.776316
264 SFD 0.469231 0.734043
265 A5D 0.468085 0.786667
266 SA8 0.468085 0.707317
267 ZDA 0.468085 0.864865
268 12D 0.46789 0.785714
269 PGS 0.467391 0.883117
270 MHZ 0.467391 0.697674
271 8PZ 0.466667 0.8
272 62F 0.466165 0.8625
273 DA 0.465909 0.878378
274 D5M 0.465909 0.878378
275 GGZ 0.464646 0.825
276 SAH 0.463158 0.74359
277 SAI 0.463158 0.734177
278 FAY 0.462687 0.8625
279 Y3J 0.4625 0.726027
280 PO4 PO4 A A A A PO4 0.460784 0.902778
281 AAM 0.460674 0.971429
282 RFL 0.459259 0.821429
283 SMM 0.459184 0.686047
284 HF7 0.459184 0.893333
285 AMZ 0.458824 0.916667
286 C2R 0.458824 0.90411
287 SAM 0.458333 0.690476
288 A3S 0.456522 0.810811
289 FNK 0.455224 0.804598
290 U A 0.453782 0.907895
291 7C5 0.453704 0.818182
292 EEM 0.453608 0.690476
293 AAT 0.453608 0.707317
294 XNP 0.452991 0.873418
295 A G 0.452991 0.883117
296 PRT 0.45283 0.931507
297 AIR 0.451219 0.901408
298 62X 0.45098 0.666667
299 DCA 0.45 0.823529
300 ETB 0.45 0.833333
301 GSP 0.45 0.873418
302 U A G G 0.449153 0.883117
303 NIA 0.448276 0.822785
304 A3T 0.446809 0.821918
305 A A A 0.446602 0.905405
306 K15 0.446602 0.682353
307 PUA 0.446281 0.884615
308 6K6 0.445545 0.930556
309 GEK 0.445545 0.7375
310 4YB 0.445455 0.761364
311 S7M 0.444444 0.690476
312 Z5A 0.443548 0.77907
313 1DG 0.443548 0.921053
314 DG1 0.443548 0.921053
315 0T1 0.442623 0.823529
316 COA 0.442623 0.823529
317 WSA 0.442478 0.788235
318 8BR 0.43956 0.906667
319 8Q2 0.438596 0.772727
320 101 0.438202 0.878378
321 IDP 0.4375 0.918919
322 NVA 2AD 0.4375 0.759494
323 9JJ 0.435714 0.8625
324 NAP 0.435484 0.945205
325 APU 0.434783 0.894737
326 A U 0.434783 0.87013
327 7RP 0.433333 0.928571
328 A6D 0.432692 0.722892
329 AMX 0.432 0.833333
330 J7V 0.432 0.833333
331 TAP 0.432 0.907895
332 COS 0.432 0.804598
333 CAO 0.432 0.795455
334 30N 0.432 0.752688
335 V1N 0.431193 0.917808
336 649 0.429825 0.744444
337 P5F 0.429577 0.823529
338 NA0 0.428571 0.932432
339 SCO 0.428571 0.823529
340 CMX 0.428571 0.823529
341 7RA 0.428571 0.957747
342 0UM 0.427184 0.698795
343 GAV 0.427184 0.884615
344 QQY 0.426966 0.815789
345 1RB 0.426966 0.885714
346 ACK 0.426966 0.861111
347 G1R 0.425743 0.907895
348 GCP 0.425743 0.896104
349 FAM 0.425197 0.804598
350 FCX 0.425197 0.795455
351 ACO 0.425197 0.795455
352 GNH 0.424242 0.907895
353 F2N 0.423611 0.813953
354 GKE 0.422018 0.884615
355 GDD 0.422018 0.884615
356 GDC 0.422018 0.884615
357 HAX 0.421875 0.804598
358 3AD 0.421687 0.805556
359 9GM 0.421569 0.896104
360 GNP 0.421569 0.896104
361 FA9 0.42069 0.864198
362 TM1 0.420561 0.77381
363 KB1 0.420561 0.698795
364 H6Y 0.42 0.945205
365 2MC 0.419847 0.769231
366 3KK 0.418605 0.804598
367 FYN 0.418605 0.823529
368 S8M 0.417476 0.759494
369 7L1 0.417323 0.795455
370 2VA 0.416667 0.8
371 26A 0.416667 0.763158
372 NHD 0.416667 0.905405
373 QQX 0.41573 0.805195
374 CA6 0.415385 0.729167
375 OXK 0.415385 0.804598
376 COK 0.415385 0.804598
377 SOP 0.415385 0.804598
378 MCD 0.415385 0.804598
379 YE1 0.413534 0.813953
380 RMB 0.413043 0.873239
381 FAI 0.413043 0.916667
382 AS 0.413043 0.833333
383 CO6 0.412214 0.804598
384 1VU 0.412214 0.795455
385 CMC 0.412214 0.804598
386 NMX 0.412214 0.76087
387 SXZ 0.411215 0.710843
388 ANZ 0.410714 0.8
389 SCA 0.410448 0.804598
390 CAJ 0.409091 0.804598
391 SCD 0.409091 0.823529
392 EO7 0.408602 0.788235
393 D3Y 0.407767 0.789474
394 CC5 0.407407 0.816901
395 KH3 0.40708 0.674419
396 A C A C 0.406504 0.848101
397 SLU 0.406504 0.770115
398 G 0.40625 0.906667
399 5GP 0.40625 0.906667
400 A1S 0.406015 0.804598
401 IVC 0.406015 0.813953
402 MLC 0.406015 0.804598
403 3HC 0.406015 0.813953
404 1HE 0.406015 0.786517
405 BCO 0.406015 0.804598
406 GTG 0.405405 0.886076
407 NMN AMP PO4 0.404959 0.87013
408 3D1 0.404762 0.773333
409 3L1 0.404762 0.773333
410 2BA 0.404255 0.915493
411 CMP 0.404255 0.901408
412 VRT 0.40404 0.769231
413 SO8 0.40404 0.789474
414 MCA 0.402985 0.795455
415 COO 0.402985 0.804598
416 CAA 0.402985 0.813953
417 3NZ 0.401869 0.782051
418 G2R 0.401869 0.884615
419 ZZB 0.4 0.77381
420 2FA 0.4 0.813333
421 MC4 0.4 0.76087
422 2CP 0.4 0.795455
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3HY2; Ligand: ATP; Similar sites found with APoc: 160
This union binding pocket(no: 1) in the query (biounit: 3hy2.bio1) has 15 residues
No: Leader PDB Ligand Sequence Similarity
1 5EP2 AZU None
2 3RV5 DXC None
3 4WG0 CHD None
4 5ET3 60C None
5 4WOP CTP 1.81818
6 5ZEC NAP 2.42718
7 2X7I CIT 3.63636
8 5M36 9SZ 3.63636
9 5MW4 5JU 3.63636
10 1AE1 NAP 3.63636
11 5W8Q BU4 3.63636
12 5CXI 5TW 3.94089
13 5N26 CPT 4.3956
14 1XX6 ADP 4.71204
15 4URG C2E 4.79042
16 4M0R 644 4.85437
17 6IIU A8X 4.85437
18 3V2U ATP 4.85437
19 1ZPD DPX 4.85437
20 3GYT DL4 4.85437
21 4PPF FLC 4.85437
22 1NU4 MLA 5.15464
23 4PC3 GDP 5.45455
24 2YFB SIN 5.45455
25 3QDK QDK 5.45455
26 5E5U MLI 5.45455
27 2GJ8 ALF GDP 5.45455
28 3FKQ ATP 5.45455
29 3PQC GDP 5.45455
30 5Z2L NDP 5.71429
31 5N8V KZZ 5.7971
32 3RUV ANP 5.82524
33 2HPL ASP ASP LEU TYR GLY 6
34 2J5V PCA 6.31068
35 1D6H COA 6.31068
36 4KM2 TOP 6.31068
37 3A28 NAD 6.31068
38 4RW3 PLM 6.36364
39 2A2C NG1 6.36364
40 2A2C ADP 6.36364
41 2XNJ NAP 6.36364
42 5IXK 6EW 6.36364
43 4B7X NAP 6.36364
44 1BDB NAD 6.36364
45 5NI5 8YB 6.36364
46 5Z69 AGS 6.36364
47 5NTW 98N 6.36364
48 1GXU 2HP 6.59341
49 1EE0 CAA 6.79612
50 1H74 ADP 6.79612
51 3CRZ NAP 7.27273
52 5FPN KYD 7.27273
53 5FJJ MAN 7.27273
54 1P3D ANP 7.27273
55 2BO4 FLC 7.27273
56 4CLI 5P8 7.27273
57 5HCV 60R 7.27273
58 1YKI NFZ 7.27273
59 1FCH TYR GLN SER LYS LEU 7.27273
60 4GBM A3P 7.27273
61 1IHU ADP 7.28155
62 4RF2 NAP 7.28155
63 4S15 4D8 7.28155
64 4DK7 0KS 7.76699
65 2QTZ NAP 8.18182
66 4I4B NAD 8.18182
67 6DEF GCP 8.18182
68 5D9O BGC BGC BGC BGC 8.18182
69 1T8U UAP SGN IDS SGN 8.18182
70 4ZKD GDP 8.18182
71 1T8U A3P 8.18182
72 1GQY ACP 8.18182
73 1PR9 NAP 8.73786
74 4YRY FAD 8.73786
75 2GWH PCI 9.09091
76 3T34 GDP 9.09091
77 1ZRH A3P 9.09091
78 1VKJ A3P 9.09091
79 5XFV FMN 9.2233
80 1TLL NAP 9.70874
81 1F20 NAP 9.70874
82 1GPE FAD 9.70874
83 2D3M COA 9.70874
84 2OG2 MLI 10
85 3B9Q MLI 10
86 6GMN F4E 10
87 5GLN XYP XYP XYP 10
88 3QVP FAD 10
89 3GGO NAI 10
90 2PO3 T4K 10.1942
91 1NB9 RBF 10.2041
92 1NB9 ADP 10.2041
93 2ED4 FAD 10.7383
94 3KMZ EQO 10.9091
95 1R6N 434 10.9091
96 2AWN ADP 10.9091
97 1T0S BML 10.9091
98 5K13 6Q7 10.9091
99 1MHC FME TYR PHE ILE ASN ILE LEU THR LEU 11.1111
100 5WX3 COA 11.165
101 1WF3 GNP 11.6505
102 1MV8 NAD 11.6505
103 6F97 FAD 11.8182
104 6DIO NAD 11.8182
105 4R5Z SIN 11.8182
106 4V3I ASP LEU THR ARG PRO 11.8182
107 3W5N RAM 11.8182
108 3ZS9 ADP ALF 11.8182
109 4XT8 NAP 11.8182
110 2WOJ ADP ALF 11.8182
111 2H8H H8H 11.8182
112 4YDS ATP 11.8182
113 6CI9 NAP 11.8182
114 3O01 DXC 12.7273
115 4DEC UDP 12.7273
116 4DEC 3PG 12.7273
117 5WRJ A3P 12.7273
118 5UFN SAH 12.7273
119 5C1M OLC 12.7273
120 4IXH IMP 12.7273
121 5WRI A3P 12.7273
122 3DUV KDO 12.7273
123 4F06 PHB 13.5922
124 2KCE D16 13.6364
125 5EOB 5QQ 13.6364
126 1I7L ATP 13.6364
127 4ZDJ UTP 13.6364
128 2OBM ADP 13.6364
129 2P4Y C03 14.0777
130 2GK6 ADP 14.0777
131 1N1G BCP 14.5455
132 1Q3Q ANP 14.5455
133 2OFV 242 14.5455
134 3NB0 G6P 14.5455
135 3RJ5 NAD 14.5631
136 3BPX SAL 14.8649
137 1HSK FAD 15.0485
138 2D5X L35 15.0685
139 5K2M ADP 15.0943
140 5LX9 OLB 15.4545
141 3C3N FMN 15.4545
142 1XZ3 ICF 16.3636
143 1QPB TPP 16.3636
144 1QPB PYM 16.3636
145 1R27 MGD 16.3636
146 2VK4 TPP 17.2727
147 4Y9J FAD 17.2727
148 2VBF TPP 17.4757
149 2IV3 UDP 18.1818
150 1W78 ADP 18.1818
151 5UGW GSH 18.2857
152 1PVN MZP 18.4466
153 5X0J SEP 19.0909
154 5X0J AMP 19.0909
155 3QFS NAP 19.0909
156 3QFS FAD 19.0909
157 4OHY ANP 19.0909
158 4O4K 2PK 19.0909
159 5L13 6ZE 20.3883
160 5NM7 GLY 22.7273
Pocket No.: 2; Query (leader) PDB : 3HY2; Ligand: ATP; Similar sites found with APoc: 27
This union binding pocket(no: 2) in the query (biounit: 3hy2.bio1) has 15 residues
No: Leader PDB Ligand Sequence Similarity
1 1MJH ATP 3.08642
2 1OVD ORO 3.63636
3 1OVD FMN 3.63636
4 2DPY ADP 5.45455
5 2IHU TP9 5.45455
6 5ESO ISC 6.36364
7 5ESO TDP 6.36364
8 1H74 ILE 6.79612
9 2F1K NAP 6.79612
10 4G86 BNT 7.76699
11 4GOX A3P 8.18182
12 5TSH ADP 8.18182
13 1KSK URA 8.25243
14 6ARJ BW4 10
15 3OV6 MK0 10
16 5B0I BOG 10
17 5LP1 71H 10.9091
18 5VW2 FDA 11.8182
19 5VW2 NAP 11.8182
20 4XT8 TMQ 11.8182
21 5W7B MYR 17.2727
22 5OJI NAP 18.1818
23 5OJI ISN 18.1818
24 3Q8G PEE 18.4466
25 1JGS SAL 19.5652
26 3B8I OXL 20.9091
27 4XZ3 COA 21.8182
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