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Receptor
PDB id Resolution Class Description Source Keywords
2JG1 2 Å EC: 2.7.1.144 STRUCTURE OF STAPHYLOCOCCUS AUREUS D-TAGATOSE-6-PHOSPHATE KINASE WITH COFACTOR AND SUBSTRATE STAPHYLOCOCCUS AUREUS D-TAGATOSE-6-PHOSPHATE KINASE PHOSPHORYL TRANSFER CONFORMATIONAL CHANGES KINASE TRANSFERASE LACTOSE METABOLISM
Ref.: STRUCTURES OF STAPHYLOCOCCUS AUREUS D-TAGATOSE-6-PHOSPHATE KINASE IMPLICATE DOMAIN MOTIONS IN SPECIFICITY AND MECHANISM. J.BIOL.CHEM. V. 282 19948 2007
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ANP A:1312;
B:1312;
C:1313;
D:1312;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
submit data
506.196 C10 H17 N6 O12 P3 c1nc(...
MG B:1311;
C:1310;
D:1311;
A:1311;
C:1311;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
submit data
24.305 Mg [Mg+2...
TA6 C:1312;
Valid;
none;
submit data
260.136 C6 H13 O9 P C([C@...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2JG1 2 Å EC: 2.7.1.144 STRUCTURE OF STAPHYLOCOCCUS AUREUS D-TAGATOSE-6-PHOSPHATE KINASE WITH COFACTOR AND SUBSTRATE STAPHYLOCOCCUS AUREUS D-TAGATOSE-6-PHOSPHATE KINASE PHOSPHORYL TRANSFER CONFORMATIONAL CHANGES KINASE TRANSFERASE LACTOSE METABOLISM
Ref.: STRUCTURES OF STAPHYLOCOCCUS AUREUS D-TAGATOSE-6-PHOSPHATE KINASE IMPLICATE DOMAIN MOTIONS IN SPECIFICITY AND MECHANISM. J.BIOL.CHEM. V. 282 19948 2007
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 2JG1 - TA6 C6 H13 O9 P C([C@@H]1[....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 2JG1 - TA6 C6 H13 O9 P C([C@@H]1[....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 2JG1 - TA6 C6 H13 O9 P C([C@@H]1[....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: ANP; Similar ligands found: 373
No: Ligand ECFP6 Tc MDL keys Tc
1 ANP 1 1
2 A2D 0.810811 0.945205
3 B4P 0.802632 0.945205
4 AP5 0.802632 0.945205
5 ADP 0.802632 0.972222
6 BA3 0.789474 0.945205
7 AU1 0.782051 1
8 HEJ 0.772152 0.972222
9 ATP 0.772152 0.972222
10 AT4 0.769231 0.933333
11 AN2 0.769231 0.986111
12 5FA 0.7625 0.972222
13 AQP 0.7625 0.972222
14 M33 0.759494 0.932432
15 MAP 0.752941 0.972973
16 ACP 0.75 0.945946
17 AR6 0.740741 0.945205
18 APR 0.740741 0.945205
19 ACQ 0.73494 0.945946
20 AD9 0.731707 0.945946
21 SAP 0.731707 0.921053
22 AGS 0.731707 0.921053
23 A 0.723684 0.944444
24 AMP 0.723684 0.944444
25 ATF 0.717647 0.933333
26 ADX 0.716049 0.851852
27 CA0 0.716049 0.92
28 6YZ 0.709302 0.945946
29 50T 0.707317 0.932432
30 PRX 0.698795 0.87013
31 ABM 0.696203 0.893333
32 AP2 0.679012 0.933333
33 A12 0.679012 0.933333
34 APC 0.678571 0.933333
35 T99 0.674419 0.933333
36 TAT 0.674419 0.933333
37 A22 0.674157 0.958904
38 SRA 0.670886 0.894737
39 SRP 0.670455 0.883117
40 5AL 0.666667 0.906667
41 A1R 0.659341 0.884615
42 ADQ 0.659341 0.92
43 A3R 0.659341 0.884615
44 3OD 0.648936 0.92
45 BIS 0.648936 0.909091
46 5SV 0.648352 0.82716
47 9X8 0.645161 0.896104
48 OAD 0.645161 0.92
49 25L 0.642105 0.958904
50 AMO 0.641304 0.907895
51 G5P 0.636364 0.897436
52 DLL 0.634409 0.906667
53 AHX 0.634409 0.897436
54 00A 0.634409 0.860759
55 ADV 0.632184 0.907895
56 RBY 0.632184 0.907895
57 ADP PO3 0.632184 0.917808
58 NB8 0.631579 0.897436
59 25A 0.630435 0.945205
60 OOB 0.630435 0.906667
61 8QN 0.630435 0.906667
62 G3A 0.626263 0.897436
63 4AD 0.623656 0.896104
64 PAJ 0.623656 0.8625
65 LAD 0.621053 0.839506
66 TXA 0.614583 0.907895
67 1ZZ 0.614583 0.819277
68 ME8 0.614583 0.819277
69 GTA 0.613861 0.864198
70 9ZD 0.612903 0.909091
71 9ZA 0.612903 0.909091
72 3UK 0.610526 0.894737
73 SON 0.604651 0.907895
74 ADP ALF 0.604396 0.848101
75 ALF ADP 0.604396 0.848101
76 PR8 0.604167 0.829268
77 B5V 0.604167 0.883117
78 WAQ 0.604167 0.860759
79 4UV 0.6 0.871795
80 GAP 0.6 0.87013
81 PTJ 0.597938 0.873418
82 FYA 0.597938 0.881579
83 VO4 ADP 0.597826 0.906667
84 ADP VO4 0.597826 0.906667
85 LMS 0.597561 0.829268
86 UP5 0.596154 0.896104
87 FA5 0.59596 0.883117
88 YAP 0.59596 0.871795
89 PAP 0.595506 0.958333
90 A4P 0.59434 0.823529
91 XAH 0.59 0.841463
92 4UU 0.588235 0.871795
93 AFH 0.588235 0.8625
94 9SN 0.585859 0.85
95 2A5 0.58427 0.894737
96 T5A 0.583333 0.821429
97 DQV 0.582524 0.932432
98 NAI 0.580952 0.884615
99 B5M 0.58 0.871795
100 B5Y 0.58 0.871795
101 ITT 0.579545 0.917808
102 ATR 0.577778 0.944444
103 OMR 0.575472 0.831325
104 5AS 0.574713 0.781609
105 YLP 0.571429 0.8
106 48N 0.571429 0.873418
107 AP0 0.570093 0.873418
108 4TC 0.570093 0.873418
109 7D3 0.569767 0.881579
110 ADJ 0.568807 0.831325
111 GNP 0.568421 0.922078
112 9GM 0.568421 0.922078
113 DAL AMP 0.568421 0.881579
114 6V0 0.566038 0.873418
115 TXD 0.566038 0.884615
116 DND 0.566038 0.907895
117 NAX 0.566038 0.851852
118 4UW 0.566038 0.839506
119 NXX 0.566038 0.907895
120 XYA 0.565789 0.821918
121 RAB 0.565789 0.821918
122 ADN 0.565789 0.821918
123 AOC 0.564706 0.8
124 7D4 0.561798 0.881579
125 ADP BMA 0.561224 0.894737
126 TXE 0.560748 0.884615
127 TYM 0.560748 0.883117
128 GA7 0.557692 0.883117
129 YLC 0.555556 0.819277
130 YLB 0.555556 0.8
131 139 0.554545 0.851852
132 5N5 0.551282 0.797297
133 JB6 0.55 0.860759
134 LAQ 0.54717 0.819277
135 F2R 0.544643 0.843373
136 MYR AMP 0.544554 0.797619
137 5CD 0.544304 0.783784
138 A4D 0.544304 0.797297
139 80F 0.54386 0.821429
140 7MD 0.542857 0.864198
141 6AD 0.542553 0.886076
142 A2R 0.541667 0.958904
143 UPA 0.541284 0.884615
144 YLA 0.540541 0.8
145 A A 0.54 0.918919
146 BTX 0.539823 0.821429
147 COD 0.539823 0.793103
148 HFD 0.537634 0.921053
149 G5A 0.537634 0.781609
150 3DH 0.535714 0.753247
151 AYB 0.535714 0.790698
152 CNA 0.535714 0.907895
153 BT5 0.535088 0.811765
154 ATP A A A 0.533981 0.905405
155 IOT 0.531532 0.811765
156 MTA 0.53012 0.753247
157 3AM 0.529412 0.90411
158 A3P 0.52809 0.944444
159 PPS 0.526316 0.851852
160 NAD 0.526316 0.906667
161 EP4 0.52439 0.734177
162 7D5 0.52381 0.855263
163 AMP DBH 0.52381 0.87013
164 J7C 0.522727 0.75
165 A5A 0.520833 0.809524
166 EAD 0.520661 0.851852
167 TSB 0.520408 0.821429
168 AHZ 0.518519 0.797619
169 DTA 0.518072 0.766234
170 M2T 0.518072 0.716049
171 A3D 0.517241 0.894737
172 6RE 0.517241 0.740741
173 YLY 0.516949 0.790698
174 SSA 0.515464 0.802326
175 NA7 0.514852 0.933333
176 ARG AMP 0.514019 0.809524
177 AR6 AR6 0.514019 0.893333
178 7MC 0.513514 0.843373
179 A2P 0.511111 0.930556
180 52H 0.510204 0.781609
181 VMS 0.510204 0.790698
182 54H 0.510204 0.790698
183 TYR AMP 0.509434 0.848101
184 TAD 0.509259 0.8625
185 NAQ 0.508333 0.85
186 A3N 0.505618 0.766234
187 AV2 0.505155 0.893333
188 53H 0.50505 0.781609
189 5CA 0.50505 0.802326
190 8X1 0.50505 0.755556
191 ARU 0.504951 0.839506
192 ZID 0.504132 0.894737
193 P1H 0.504 0.831325
194 NAE 0.5 0.871795
195 3AT 0.5 0.945205
196 AVV 0.5 0.873418
197 P5A 0.495146 0.747253
198 NSS 0.49505 0.802326
199 LSS 0.49505 0.764045
200 DSZ 0.49505 0.802326
201 N0B 0.491803 0.8
202 AF3 ADP 3PG 0.491071 0.817073
203 NVA LMS 0.490196 0.755556
204 DAT 0.489362 0.881579
205 IMO 0.488889 0.90411
206 ZAS 0.488636 0.792208
207 FDA 0.488372 0.813953
208 NAJ PZO 0.487395 0.85
209 4TA 0.487179 0.788235
210 LPA AMP 0.486486 0.797619
211 LEU LMS 0.485437 0.755556
212 DTP 0.484536 0.881579
213 V3L 0.484536 0.945205
214 S4M 0.483516 0.651685
215 GJV 0.483516 0.731707
216 DZD 0.483051 0.8625
217 2AM 0.482759 0.917808
218 5AD 0.481013 0.726027
219 GSU 0.480769 0.781609
220 KAA 0.480769 0.755556
221 NDE 0.480315 0.907895
222 M24 0.479339 0.851852
223 MAO 0.478261 0.761905
224 NEC 0.477778 0.727273
225 DSH 0.477778 0.707317
226 FAS 0.477273 0.831325
227 FAD 0.477273 0.831325
228 RGT 0.476636 0.933333
229 9K8 0.47619 0.698925
230 G A A A 0.474576 0.85
231 0WD 0.474576 0.897436
232 FNK 0.474074 0.786517
233 5X8 0.473684 0.74359
234 6FA 0.473282 0.821429
235 NDC 0.472868 0.85
236 FB0 0.472868 0.786517
237 YSA 0.472222 0.781609
238 7DD 0.468085 0.958333
239 OVE 0.466667 0.881579
240 MHZ 0.463158 0.701149
241 8PZ 0.462963 0.802326
242 A G 0.462185 0.860759
243 AMP NAD 0.462185 0.881579
244 A3G 0.461538 0.779221
245 NAJ PYZ 0.459677 0.809524
246 6C6 0.459184 0.858974
247 SFG 0.458333 0.730769
248 U A G G 0.458333 0.860759
249 7D7 0.45679 0.723684
250 128 0.45614 0.8
251 SFD 0.455224 0.736842
252 6IA 0.454545 0.817073
253 DDS 0.454545 0.855263
254 GDP 0.454545 0.896104
255 ODP 0.453782 0.886076
256 NJP 0.453782 0.921053
257 7DT 0.453608 0.958333
258 A7D 0.452632 0.75641
259 Z5A 0.452381 0.802326
260 WSA 0.452174 0.790698
261 U A 0.45082 0.884615
262 7C5 0.45045 0.797468
263 FAY 0.449275 0.841463
264 NDP 0.449153 0.897436
265 SA8 0.44898 0.690476
266 A5D 0.44898 0.766234
267 71V 0.446809 0.884615
268 GGZ 0.446602 0.804878
269 RFL 0.446043 0.802326
270 2SA 0.445545 0.907895
271 SAI 0.444444 0.716049
272 GP3 0.444444 0.897436
273 SAH 0.444444 0.725
274 PO4 PO4 A A A A PO4 0.443396 0.878378
275 A A A 0.443396 0.881579
276 4YB 0.442478 0.764045
277 SMM 0.441176 0.670455
278 S7M 0.441176 0.674419
279 GTP 0.441176 0.896104
280 Y3J 0.440476 0.706667
281 SAM 0.44 0.674419
282 649 0.439655 0.747253
283 12D 0.438596 0.809524
284 A3S 0.4375 0.789474
285 NPW 0.436975 0.864198
286 GCP 0.436893 0.873418
287 AAT 0.435644 0.690476
288 GNH 0.435644 0.909091
289 EEM 0.435644 0.674419
290 ETB 0.435484 0.813953
291 DCA 0.435484 0.804598
292 N6P 0.433962 0.890411
293 NZQ 0.433333 0.886076
294 TXP 0.433333 0.897436
295 PGS 0.43299 0.860759
296 APU 0.432203 0.871795
297 PUA 0.432 0.8625
298 62F 0.431655 0.841463
299 F2N 0.431507 0.795455
300 DA 0.430108 0.855263
301 D5M 0.430108 0.855263
302 J7V 0.429688 0.813953
303 NIA 0.428571 0.848101
304 COA 0.428571 0.804598
305 6K6 0.428571 0.905405
306 A3T 0.428571 0.8
307 0T1 0.428571 0.804598
308 P5F 0.427586 0.804598
309 AAM 0.425532 0.944444
310 0UM 0.424528 0.682353
311 8Q2 0.423729 0.775281
312 G1R 0.423077 0.884615
313 AMZ 0.422222 0.891892
314 C2R 0.422222 0.88
315 A U 0.420168 0.848101
316 IDP 0.42 0.894737
317 GSP 0.419048 0.851852
318 30N 0.418605 0.736842
319 CAO 0.418605 0.777778
320 DG1 0.418605 0.897436
321 1DG 0.418605 0.897436
322 COS 0.418605 0.786517
323 AMX 0.418605 0.813953
324 TM1 0.418182 0.797619
325 A6D 0.416667 0.746988
326 K15 0.416667 0.666667
327 V1N 0.415929 0.893333
328 CMX 0.415385 0.804598
329 SCO 0.415385 0.804598
330 GEK 0.415094 0.719512
331 XNP 0.414634 0.851852
332 NHD 0.414634 0.881579
333 9JJ 0.413793 0.841463
334 AIR 0.413793 0.876712
335 COK 0.413534 0.786517
336 G2R 0.412844 0.8625
337 ACO 0.412214 0.777778
338 FAM 0.412214 0.786517
339 FCX 0.412214 0.777778
340 NAP 0.410853 0.92
341 FA9 0.409396 0.843373
342 SXZ 0.409091 0.694118
343 HAX 0.409091 0.806818
344 TAP 0.407692 0.884615
345 2MC 0.407407 0.752688
346 62X 0.407407 0.651685
347 GKE 0.40708 0.8625
348 GDC 0.40708 0.8625
349 GDD 0.40708 0.8625
350 3KK 0.406015 0.786517
351 FYN 0.406015 0.804598
352 NVA 2AD 0.405941 0.740741
353 NA0 0.40458 0.907895
354 101 0.404255 0.855263
355 G 0.40404 0.883117
356 5GP 0.40404 0.883117
357 HDV 0.403846 0.87013
358 MGP 0.403846 0.8625
359 OXK 0.402985 0.786517
360 MCD 0.402985 0.786517
361 CA6 0.402985 0.714286
362 SOP 0.402985 0.786517
363 3AD 0.402299 0.783784
364 S8M 0.401869 0.78481
365 YE1 0.40146 0.795455
366 NMX 0.4 0.782609
367 7RP 0.4 0.902778
368 2VA 0.4 0.779221
369 1VU 0.4 0.777778
370 CO6 0.4 0.786517
371 CMC 0.4 0.786517
372 6G0 0.4 0.8625
373 GMV 0.4 0.873418
Ligand no: 2; Ligand: TA6; Similar ligands found: 20
No: Ligand ECFP6 Tc MDL keys Tc
1 F6P 1 1
2 TA6 1 1
3 FBP 0.666667 0.954545
4 AFP 0.666667 0.954545
5 SF9 0.564103 0.744186
6 PSV 0.564103 0.744186
7 LFR 0.564103 0.744186
8 SF6 0.564103 0.744186
9 FRU 0.564103 0.744186
10 FDP 0.55102 0.954545
11 F1X 0.531915 1
12 LBS 0.490566 0.755556
13 FRU FRU 0.490566 0.755556
14 0UB 0.464286 0.755556
15 S7P 0.444444 0.976744
16 AHG 0.431818 0.886364
17 SUP 0.40625 0.913043
18 RP5 0.404255 0.906977
19 HSX 0.404255 0.906977
20 ABF 0.404255 0.906977
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2JG1; Ligand: TA6; Similar sites found with APoc: 79
This union binding pocket(no: 1) in the query (biounit: 2jg1.bio2) has 16 residues
No: Leader PDB Ligand Sequence Similarity
1 3HQ9 OXL 1.51515
2 2GJN NIS 1.82927
3 6F3M NAD 2.12121
4 4R74 F6P 2.49221
5 4XF6 LIP 2.5641
6 4XF6 ADP 2.5641
7 4XF6 INS 2.5641
8 1UA4 GLC 2.72727
9 1UA4 BGC 2.72727
10 2TPL HPP 2.72727
11 1EM6 NBG 2.72727
12 3HMO STU 2.72727
13 6ECG PM9 2.72727
14 1E8G FCR 2.72727
15 1E8G FAD 2.72727
16 1Q19 SSC 2.72727
17 3B8X G4M 2.72727
18 5O5Y GLC 3.0303
19 1RO7 CSF 3.0888
20 4HVK PMP 3.14136
21 1NYW DAU 3.5533
22 3PPQ CHT 3.63636
23 5DXI TRE 3.64238
24 5O0J GLC 3.93939
25 5GVL PLG 3.93939
26 5GVL GI8 3.93939
27 3K4Z CBI 4.15225
28 4XJ6 GH3 4.1769
29 5O2Z FLC 4.20168
30 4JH6 FCN 4.34783
31 3HSS MLA 4.77816
32 5FXD H7Y 4.84848
33 3LOO B4P 5.15152
34 2ZWA SAH 5.17986
35 1DFO PLG 5.45455
36 1ZHX HC3 5.75758
37 6GNF GLC 6.06061
38 1P0Z FLC 6.10687
39 5OD2 GLC 6.36364
40 3QP8 HL0 6.52174
41 5W19 9TD 6.66667
42 1UGY GLA BGC 6.76692
43 3M3E GAL A2G NPO 6.8323
44 4WXG 2BO 6.9697
45 5YSQ INS 6.99301
46 3QVP FAD 7.27273
47 5D6T NGA 7.35294
48 2C1Q BTN 7.93651
49 3VHH VHH 8.13008
50 1GG6 APL 8.24742
51 2VAR KDF 8.30671
52 2VAR KDG 8.30671
53 1Q6O LG6 8.33333
54 2OFV 242 8.66426
55 4AZJ SEP PLP 9.09091
56 5KGS 6SR 9.19037
57 2HW1 FRU 9.39597
58 3BGD PM6 9.61539
59 3VP6 HLD 10
60 4C2V YJA 11.3636
61 4Y24 TD2 12.3377
62 4BJ8 BTN 12.6984
63 3ZRR PXG 12.7604
64 4XDA ADP 13.5922
65 4XDA RIB 13.5922
66 6CD1 PLG 13.9394
67 6CD1 PLS 13.9394
68 2I6A 5I5 14.2424
69 1RKD RIB 15.2104
70 1RKD ADP 15.2104
71 3B1Q NOS 15.6442
72 2ABS ACP 17.8788
73 3NC9 TR3 19.1693
74 2C49 ADN 19.2053
75 4PVV HO4 25
76 1QIN GIP 28.9617
77 3OTX AP5 32.7273
78 1V1A KDG 36.5696
79 3CQD ATP 42.7184
Pocket No.: 2; Query (leader) PDB : 2JG1; Ligand: ANP; Similar sites found with APoc: 85
This union binding pocket(no: 2) in the query (biounit: 2jg1.bio2) has 21 residues
No: Leader PDB Ligand Sequence Similarity
1 4WG0 CHD None
2 4WGF HX2 0.97561
3 4MGA 27L 1.17647
4 4RKK GLC GLC GLC GLC GLC GLC 1.21212
5 2ZX2 RAM 1.53846
6 1OFS SUC 1.60428
7 1PVN MZP 2.12121
8 5WQJ 7N3 2.3569
9 4WBD CIT 2.42424
10 4XF6 ADP 2.5641
11 4XF6 LIP 2.5641
12 4XF6 INS 2.5641
13 1OVD ORO 2.57235
14 1OVD FMN 2.57235
15 3ZS7 ATP 2.66667
16 1Q19 SSC 2.72727
17 2OWZ CIT 2.72727
18 1UA4 AMP 2.72727
19 1YBH P22 3.0303
20 4L9Z OXL 3.0303
21 3WCS MAN NAG 3.14961
22 3WCS MAN NAG GAL 3.14961
23 5TCI MLI 3.26087
24 2BQP GLC 3.4188
25 1FFU CDP 3.48432
26 4EN4 GT0 3.52564
27 4EN4 ATP 3.52564
28 4EN4 GT1 3.52564
29 1T9D P22 3.69276
30 5O0J 8BR 3.93939
31 1ZGS XMM 3.93939
32 6F5W KG1 4.24242
33 2X1E X1E 4.24242
34 1GOJ ADP 4.24242
35 1G6H ADP 4.28016
36 1JJV ATP 4.36893
37 2J5V PCA 4.54545
38 1VLJ NAP 4.84848
39 3LOO B4P 5.15152
40 4GYS MLI 5.15152
41 4XFR CIT 5.15152
42 3K56 IS3 5.26316
43 3AB4 THR 5.61798
44 5TSH ADP 5.75758
45 3O01 DXC 6.16883
46 1XPJ TLA 6.34921
47 5OD2 5ID 6.36364
48 4A59 AMP 6.36364
49 3B6C SDN 6.41026
50 1O5Q PYR 6.55738
51 5YSQ INS 6.99301
52 2C3H GLC GLC 7.14286
53 3RS8 APR 7.27273
54 3JYY PPV 7.31707
55 6C0B MLI 7.69231
56 6C0B PAM 7.69231
57 2DT9 THR 7.78443
58 5N5U 7N8 8.28025
59 2VAR ANP 8.30671
60 2VAR AMP 8.30671
61 5H4S RAM 8.4507
62 2AWN ADP 8.78788
63 5YW5 ADE 8.93855
64 4C5N PXL 9.05797
65 4C5N ACP 9.05797
66 4RVU NDP 9.09091
67 3DRW AMP 9.39394
68 2HW1 ANP 9.39597
69 6BSX GDP 10.1124
70 6BSX E7S 10.1124
71 4XCP PLM 12.3529
72 4XDA RIB 13.5922
73 4XDA ADP 13.5922
74 3RF4 FUN 13.7931
75 1RKD ADP 15.2104
76 1RKD RIB 15.2104
77 2ABS ACP 17.8788
78 2ZRU FMN 18.7879
79 3NC9 TR3 19.1693
80 2C49 ANP 19.2053
81 4H2W AMP 20.3883
82 4PVV HO4 25
83 3OTX AP5 32.7273
84 1V1A ADP 36.5696
85 3CQD ATP 42.7184
Pocket No.: 3; Query (leader) PDB : 2JG1; Ligand: ANP; Similar sites found with APoc: 34
This union binding pocket(no: 3) in the query (biounit: 2jg1.bio2) has 23 residues
No: Leader PDB Ligand Sequence Similarity
1 3LE7 ADE 1.14943
2 1JT1 MCO 1.52091
3 1XMV ADP 2.12121
4 1DMY AZM 2.41935
5 1IZC PYR 2.65487
6 1LES GLC FRU 2.76243
7 1Q8O MAN MMA 2.77778
8 2GMM MAN MAN 2.77778
9 1UKG MMA 2.77778
10 4DDY DN6 3.04183
11 1OCU PIB 3.08642
12 1IGW PYR 3.93939
13 4MOB ADP 4.24242
14 3BJE URA 4.24242
15 3LL5 IP8 4.41767
16 1JJ7 ADP 4.61538
17 2CBZ ATP 4.64135
18 2OG7 AHB 4.84848
19 5L2R MLA 5.75758
20 2XYA 7L4 5.75758
21 1ELI PYC 6.9697
22 6BYF CIT 7.05882
23 6EK3 OUL 7.23982
24 6C4A PYR 7.57576
25 2O66 FLC 8.14815
26 1COY FAD 8.78788
27 6GNO XDI 9.62963
28 1NX0 ALA LYS ALA ILE ALA 9.82659
29 3ZJX BOG 10.3806
30 1JNR FAD 10.9091
31 4BHL ARG 12.7273
32 3HQP OXL 13.0303
33 4F4S EFO 17.1053
34 4OGQ 1O2 35.1351
Pocket No.: 4; Query (leader) PDB : 2JG1; Ligand: ANP; Similar sites found with APoc: 13
This union binding pocket(no: 4) in the query (biounit: 2jg1.bio1) has 21 residues
No: Leader PDB Ligand Sequence Similarity
1 1LVW TYD 2.37288
2 2PHU MAN MAN MAN BMA MAN 2.77778
3 2PHT MAN MAN MAN BMA MAN 2.77778
4 5FII PHE 4.90196
5 6A4R ASP 4.90566
6 1OFD AKG 6.9697
7 1OFD FMN 6.9697
8 5F90 GLA GAL 8.97436
9 3H4S ADP 9.69697
10 4FRZ ADP 9.69697
11 5UQW GDP 10.0529
12 3CF6 SP1 10.1796
13 5MWE TCE 12.3457
Pocket No.: 5; Query (leader) PDB : 2JG1; Ligand: ANP; Similar sites found with APoc: 12
This union binding pocket(no: 5) in the query (biounit: 2jg1.bio1) has 21 residues
No: Leader PDB Ligand Sequence Similarity
1 2OUA AES 2.12766
2 4G05 JZ3 2.2082
3 5NM7 GLY 2.63158
4 5WXU IAC 3.0303
5 3L6R MLI 3.0303
6 1ZED PNP 4.84848
7 5TE1 7A2 5.45455
8 1YNQ NDP 5.99369
9 5HWV MBN 8.46154
10 1QF5 GDP 9.39394
11 1QF5 RPL 9.39394
12 1JAY NAP 15.566
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