Receptor
PDB id Resolution Class Description Source Keywords
1Q19 2.4 Å EC: 7.-.-.- CARBAPENAM SYNTHETASE PECTOBACTERIUM CAROTOVORUM CMPR (2S5S)-5-CARBOXYMETHYLPROLINE; B-LS B-LACTAM SYNTHETASE; AS-B CLASS B ASPARAGINE SYNTHETASE; AMP-CPP AB-METHYLENEADENOSINE 5-TRIPHOSPHATE; CEA N2-(CARBOXYETHYL)L-ARGININE; CMA N2-(CARBOXYLMETHYL)-L-ARGININE BIOSYNTHETIC PROTEIN
Ref.: CRYSTAL STRUCTURE OF CARBAPENAM SYNTHETASE (CARA) J.BIOL.CHEM. V. 278 40996 2003
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
APC A:505;
B:505;
C:505;
D:505;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
submit data
505.208 C11 H18 N5 O12 P3 c1nc(...
MG A:504;
B:504;
C:504;
D:504;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
none;
none;
none;
none;
submit data
24.305 Mg [Mg+2...
SSC A:506;
B:506;
C:506;
D:506;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
submit data
173.167 C7 H11 N O4 C1C[C...
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90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1Q19 2.4 Å EC: 7.-.-.- CARBAPENAM SYNTHETASE PECTOBACTERIUM CAROTOVORUM CMPR (2S5S)-5-CARBOXYMETHYLPROLINE; B-LS B-LACTAM SYNTHETASE; AS-B CLASS B ASPARAGINE SYNTHETASE; AMP-CPP AB-METHYLENEADENOSINE 5-TRIPHOSPHATE; CEA N2-(CARBOXYETHYL)L-ARGININE; CMA N2-(CARBOXYLMETHYL)-L-ARGININE BIOSYNTHETIC PROTEIN
Ref.: CRYSTAL STRUCTURE OF CARBAPENAM SYNTHETASE (CARA) J.BIOL.CHEM. V. 278 40996 2003
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 250 families.
1 1Q19 - SSC C7 H11 N O4 C1C[C@H](N....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 217 families.
1 1Q19 - SSC C7 H11 N O4 C1C[C@H](N....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 181 families.
1 1Q19 - SSC C7 H11 N O4 C1C[C@H](N....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: APC; Similar ligands found: 330
No: Ligand ECFP6 Tc MDL keys Tc
1 APC 1 1
2 ACQ 0.831169 0.986301
3 A12 0.821918 1
4 AP2 0.821918 1
5 ADV 0.805195 0.972973
6 RBY 0.805195 0.972973
7 A 0.777778 0.931507
8 AMP 0.777778 0.931507
9 ADP 0.763158 0.958904
10 ACP 0.75641 0.986301
11 A2D 0.746667 0.932432
12 AP5 0.74026 0.932432
13 B4P 0.74026 0.932432
14 ATP 0.734177 0.958904
15 BA3 0.727273 0.932432
16 AQP 0.725 0.958904
17 5FA 0.725 0.958904
18 ABM 0.723684 0.881579
19 AMP MG 0.710526 0.857143
20 AN2 0.708861 0.945946
21 M33 0.7 0.92
22 TAT 0.698795 0.921053
23 SRA 0.697368 0.883117
24 AR6 0.682927 0.932432
25 APR 0.682927 0.932432
26 ADP MG 0.679012 0.87013
27 CA0 0.679012 0.907895
28 AU1 0.679012 0.933333
29 ADX 0.679012 0.841463
30 ANP 0.678571 0.933333
31 ADP PO3 0.674699 0.905405
32 SAP 0.674699 0.909091
33 AGS 0.674699 0.909091
34 AD9 0.674699 0.933333
35 BEF ADP 0.670732 0.848101
36 50T 0.670732 0.92
37 ADP BEF 0.670732 0.848101
38 ATP MG 0.666667 0.87013
39 PRX 0.662651 0.858974
40 ATF 0.643678 0.921053
41 MAP 0.640449 0.909091
42 A22 0.640449 0.945946
43 GAP 0.639535 0.858974
44 TAD 0.632653 0.923077
45 5AL 0.632184 0.894737
46 SON 0.626506 0.946667
47 ADQ 0.626374 0.907895
48 ADP ALF 0.625 0.8375
49 ALF ADP 0.625 0.8375
50 ANP MG 0.617977 0.860759
51 SRP 0.617977 0.896104
52 ADP VO4 0.617977 0.894737
53 VO4 ADP 0.617977 0.894737
54 25A 0.615385 0.932432
55 RAB 0.611111 0.810811
56 XYA 0.611111 0.810811
57 ADN 0.611111 0.810811
58 25L 0.610526 0.945946
59 A1R 0.608696 0.922078
60 4AD 0.608696 0.909091
61 DAL AMP 0.604396 0.87013
62 5SV 0.597826 0.839506
63 8QN 0.597826 0.894737
64 OOB 0.597826 0.894737
65 ADP BMA 0.595745 0.883117
66 OAD 0.595745 0.907895
67 PAJ 0.591398 0.851852
68 AMO 0.591398 0.921053
69 AOC 0.585366 0.789474
70 DLL 0.585106 0.894737
71 AHX 0.585106 0.886076
72 00A 0.585106 0.85
73 BIS 0.583333 0.897436
74 3OD 0.583333 0.907895
75 PTJ 0.583333 0.8625
76 3UK 0.578947 0.883117
77 DZD 0.577982 0.923077
78 5AS 0.576471 0.752809
79 5N5 0.573333 0.786667
80 PR8 0.572917 0.864198
81 WAQ 0.572917 0.897436
82 LAD 0.572917 0.875
83 4TC 0.571429 0.910256
84 ME8 0.56701 0.831325
85 TXA 0.56701 0.896104
86 1ZZ 0.56701 0.831325
87 FYA 0.56701 0.894737
88 NB8 0.56701 0.886076
89 5CD 0.565789 0.773333
90 A4D 0.565789 0.786667
91 ATP A A A 0.565657 0.893333
92 A3P 0.564706 0.931507
93 7D5 0.5625 0.868421
94 PAP 0.561798 0.945205
95 MYR AMP 0.561224 0.809524
96 G5P 0.558824 0.886076
97 M2T 0.556962 0.707317
98 A A 0.556701 0.906667
99 9SN 0.555556 0.839506
100 G2P 0.553191 0.923077
101 7D3 0.552941 0.894737
102 TXD 0.552381 0.873418
103 UP5 0.552381 0.884615
104 JB6 0.55102 0.873418
105 2A5 0.550562 0.907895
106 FA5 0.55 0.896104
107 YAP 0.55 0.884615
108 G3A 0.54902 0.886076
109 3AM 0.548781 0.891892
110 A2P 0.546512 0.917808
111 7D4 0.545455 0.894737
112 XAH 0.544554 0.853659
113 TYR AMP 0.544554 0.848101
114 ATR 0.544444 0.931507
115 EP4 0.544304 0.725
116 AFH 0.543689 0.875
117 4UV 0.539216 0.860759
118 G5A 0.538462 0.772727
119 GTA 0.538462 0.853659
120 NAI 0.537736 0.873418
121 DTA 0.5375 0.779221
122 3DH 0.536585 0.74359
123 AHZ 0.533333 0.788235
124 ARG AMP 0.533333 0.821429
125 LAQ 0.533333 0.831325
126 MTA 0.530864 0.74359
127 AR6 AR6 0.528846 0.881579
128 7MD 0.528846 0.853659
129 4UU 0.528846 0.860759
130 48N 0.528302 0.886076
131 LPA AMP 0.528302 0.809524
132 ITT 0.52809 0.905405
133 AMP DBH 0.524272 0.858974
134 NAX 0.523364 0.864198
135 DND 0.523364 0.896104
136 NXX 0.523364 0.896104
137 4UW 0.523364 0.829268
138 6V0 0.523364 0.8625
139 IMO 0.523256 0.891892
140 A4P 0.522936 0.813953
141 A5A 0.521277 0.77907
142 TSB 0.520833 0.790698
143 OMR 0.518519 0.843373
144 TXE 0.518519 0.873418
145 2AM 0.518072 0.905405
146 6RE 0.517647 0.753086
147 S4M 0.517241 0.681818
148 V3L 0.516129 0.932432
149 SSA 0.515789 0.793103
150 YLP 0.514019 0.833333
151 AP0 0.513761 0.8625
152 UPA 0.513761 0.873418
153 139 0.513514 0.864198
154 T5A 0.513514 0.855422
155 PPS 0.510638 0.841463
156 A2R 0.510417 0.945946
157 54H 0.510417 0.761364
158 VMS 0.510417 0.761364
159 52H 0.510417 0.752809
160 CNA 0.508929 0.896104
161 ZAS 0.505882 0.7375
162 A3N 0.505747 0.75641
163 J7C 0.505747 0.7625
164 5X8 0.505495 0.75641
165 53H 0.505155 0.752809
166 5CA 0.505155 0.793103
167 ALF ADP 3PG 0.504587 0.829268
168 LA8 ALF 3PG 0.504587 0.829268
169 AF3 ADP 3PG 0.504587 0.829268
170 TYM 0.504587 0.896104
171 IOT 0.504505 0.845238
172 YLC 0.5 0.853659
173 ADJ 0.5 0.843373
174 OVE 0.5 0.87013
175 YLB 0.5 0.833333
176 7MC 0.5 0.833333
177 P5A 0.49505 0.758242
178 NSS 0.494949 0.793103
179 LSS 0.494949 0.755556
180 DSZ 0.494949 0.793103
181 6AD 0.494737 0.875
182 MAO 0.494382 0.77381
183 DSH 0.494253 0.740741
184 A3D 0.491379 0.883117
185 NVA LMS 0.49 0.736264
186 AV2 0.489583 0.881579
187 COD 0.486957 0.825581
188 NAD 0.486957 0.894737
189 4TA 0.486957 0.821429
190 YLA 0.486726 0.833333
191 NA7 0.485149 0.972973
192 LEU LMS 0.485149 0.736264
193 3AT 0.484211 0.958904
194 GJV 0.483146 0.743902
195 AYB 0.482456 0.823529
196 5AD 0.480519 0.716216
197 GSU 0.480392 0.772727
198 KAA 0.480392 0.766667
199 NAD IBO 0.478261 0.8375
200 71V 0.477778 0.873418
201 A3G 0.477273 0.792208
202 7D7 0.474359 0.736842
203 BTX 0.474138 0.855422
204 G A A A 0.474138 0.839506
205 6C6 0.473684 0.896104
206 DAT 0.473118 0.92
207 SFG 0.473118 0.766234
208 YSA 0.471698 0.772727
209 PO4 PO4 A A A A PO4 0.470588 0.866667
210 BT5 0.470085 0.845238
211 AVV 0.47 0.910256
212 SMM 0.469388 0.701149
213 6IA 0.46875 0.829268
214 SAM 0.46875 0.705882
215 DTP 0.46875 0.92
216 A7D 0.467391 0.792208
217 AMP NAD 0.467213 0.848101
218 M24 0.466667 0.819277
219 SA8 0.463158 0.722892
220 A5D 0.463158 0.779221
221 NAE 0.46281 0.860759
222 PGS 0.462366 0.85
223 MHZ 0.462366 0.712644
224 NAJ PZO 0.462185 0.817073
225 DA 0.460674 0.893333
226 D5M 0.460674 0.893333
227 NEC 0.460674 0.717949
228 EAD 0.459677 0.841463
229 2SA 0.459184 0.921053
230 NAQ 0.459016 0.839506
231 NAJ PYZ 0.459016 0.819277
232 SAH 0.458333 0.759494
233 SAI 0.458333 0.75
234 Y3J 0.45679 0.697368
235 A A A 0.456311 0.92
236 AAM 0.455556 0.931507
237 6K6 0.455446 0.893333
238 ZID 0.455285 0.883117
239 4YB 0.454545 0.755556
240 S7M 0.454545 0.705882
241 YLY 0.454545 0.823529
242 PLP AAD 0.453782 0.736264
243 AMZ 0.453488 0.88
244 C2R 0.453488 0.868421
245 Z5A 0.451613 0.772727
246 7DD 0.451613 0.945205
247 A3S 0.451613 0.802632
248 7C5 0.449541 0.7875
249 101 0.449438 0.868421
250 EEM 0.44898 0.705882
251 N6P 0.446602 0.878378
252 ARU 0.446602 0.829268
253 AIR 0.445783 0.864865
254 U A G G 0.445378 0.85
255 P1H 0.445312 0.821429
256 NDE 0.445312 0.896104
257 N0B 0.443548 0.833333
258 A U 0.443478 0.8375
259 NIA 0.443182 0.792683
260 A3T 0.442105 0.789474
261 GEK 0.441176 0.753086
262 GP2 0.438776 0.923077
263 DDS 0.438776 0.868421
264 WSA 0.438596 0.781609
265 7DT 0.4375 0.945205
266 0WD 0.436975 0.886076
267 8BR 0.434783 0.871795
268 AAT 0.434343 0.722892
269 TXP 0.432203 0.886076
270 GGZ 0.431373 0.795181
271 NJP 0.428571 0.909091
272 A6D 0.428571 0.717647
273 FB0 0.427481 0.83908
274 NDC 0.427481 0.8625
275 649 0.426087 0.758242
276 7RA 0.423913 0.918919
277 NDP 0.423729 0.886076
278 0UM 0.423077 0.714286
279 ACK 0.422222 0.826667
280 QQY 0.422222 0.78481
281 RGT 0.422018 0.921053
282 FDA 0.421053 0.825581
283 CC5 0.419753 0.808219
284 ANZ 0.419643 0.771084
285 62X 0.419048 0.681818
286 APU 0.418803 0.860759
287 6FA 0.41791 0.833333
288 128 0.417391 0.75
289 ODP 0.416667 0.875
290 TM1 0.416667 0.747126
291 3AD 0.416667 0.797297
292 K15 0.415094 0.697674
293 2BA 0.414894 0.878378
294 CMP 0.414894 0.864865
295 V1N 0.414414 0.881579
296 S8M 0.413462 0.775
297 7RP 0.413043 0.890411
298 2VA 0.412371 0.769231
299 12D 0.412281 0.758621
300 SFD 0.411765 0.729167
301 NPW 0.411765 0.876543
302 FAS 0.411765 0.843373
303 2FA 0.411765 0.782051
304 FAD 0.411765 0.843373
305 QQX 0.411111 0.775
306 62F 0.410072 0.853659
307 FAI 0.408602 0.88
308 RMB 0.408602 0.837838
309 AS 0.408602 0.848101
310 NZQ 0.408333 0.898734
311 GCP 0.407767 0.910256
312 SXZ 0.407407 0.72619
313 SP1 0.406593 0.810127
314 RP1 0.406593 0.810127
315 U G A 0.404412 0.809524
316 D3Y 0.403846 0.782051
317 KB1 0.40367 0.714286
318 N01 0.403226 0.87013
319 SLU 0.403226 0.744444
320 5GP 0.402062 0.871795
321 G 0.402062 0.871795
322 NMN AMP PO4 0.401639 0.8375
323 XNP 0.401639 0.841463
324 SO8 0.4 0.759494
325 VRT 0.4 0.7625
326 DCA 0.4 0.837209
327 3L1 0.4 0.789474
328 3D1 0.4 0.789474
329 FNK 0.4 0.797753
330 ETB 0.4 0.825581
Ligand no: 2; Ligand: SSC; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 SSC 1 1
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1Q19; Ligand: SSC; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 1) in the query (biounit: 1q19.bio1) has 9 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 1Q19; Ligand: APC; Similar sites found: 125
This union binding pocket(no: 2) in the query (biounit: 1q19.bio1) has 23 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1C4Q GLA GAL BGC 0.003118 0.43546 None
2 1D8C GLV 0.02364 0.40082 0.994036
3 5F7J ADE 0.004874 0.44252 1.25
4 3CV2 OXL 0.0278 0.40549 1.39165
5 3B5J 12D 0.004875 0.44053 1.64609
6 1XP8 AGS 0.009361 0.42124 1.91257
7 5A7Y SAH 0.00565 0.43223 1.92308
8 2WHX ADP 0.006856 0.43616 1.98807
9 4L80 OXL 0.01429 0.41607 2.01149
10 4HSE ADP 0.007061 0.41855 2.01511
11 5AHW CMP 0.0002217 0.44329 2.04082
12 4PPF FLC 0.007546 0.42339 2.28571
13 3NHB ADP 0.003842 0.4485 2.28758
14 2XT3 ADP 0.003628 0.45293 2.32558
15 1YQT ADP 0.005669 0.43985 2.38569
16 1JWY ADP 0.006363 0.4207 2.38569
17 2EB5 OXL 0.02137 0.40574 2.62172
18 3WY9 GDP 0.01121 0.41731 2.76498
19 3WYA GDP 0.01615 0.40523 2.76498
20 4G5G GDP 0.01273 0.41031 2.79188
21 3U6K GDP 0.01408 0.40815 2.79188
22 3U6B GDP 0.01774 0.40729 2.79188
23 5JBQ GDP 0.01597 0.40548 2.79188
24 3AIA SAM 0.001187 0.40951 2.8436
25 5IFK HPA 0.003079 0.45111 2.88462
26 4J0Q GDP 0.01302 0.41405 3.00231
27 3DZD ADP 0.01084 0.40221 3.26087
28 5KJW 53C 0.01708 0.41544 3.27869
29 1EXF GLY 0.0008889 0.43842 3.30579
30 5TH5 MET 0.01539 0.4148 3.42205
31 3NEM ATP 0.007969 0.42026 3.42466
32 3KYF 5GP 5GP 0.01458 0.40741 3.4632
33 3ESS 18N 0.001552 0.46764 3.47826
34 5EWK P34 0.01487 0.41711 3.5
35 2PZ8 APC 0.000001443 0.55106 3.52113
36 4YJK URA 0.006496 0.43098 3.57143
37 1I4D GDP 0.0185 0.40636 3.64583
38 1KQP ADJ 0.0000326 0.53055 3.69004
39 5LTJ ADP 0.01299 0.4059 3.77734
40 4WZ6 ATP 0.01816 0.41342 3.7931
41 2QZ4 ADP 0.0121 0.4036 3.81679
42 5F6U 5VK 0.01979 0.40576 3.82166
43 4AG5 ADP 0.004293 0.4464 3.82653
44 5H5F SAM 0.002115 0.41351 3.84615
45 5MX4 HPA 0.002694 0.45602 3.86266
46 1SKQ GDP 0.01441 0.41182 3.90805
47 4FK7 P34 0.008083 0.4311 3.93013
48 1FQK ALF 0.01893 0.41068 4.08163
49 1FQJ ALF 0.02807 0.40282 4.08163
50 3I7S PYR 0.01412 0.41981 4.10959
51 3G6K FAD 0.000006823 0.54367 4.22078
52 3G6K POP 0.00000624 0.54176 4.22078
53 2WSI FAD 0.0004198 0.44837 4.24837
54 5NE2 DGL 0.02651 0.41205 4.31655
55 5L3V GDP 0.01268 0.40266 4.34783
56 2CHG ANP 0.008509 0.4001 4.42478
57 1JI0 ATP 0.002768 0.45316 4.58333
58 2OG2 MLI 0.0008507 0.4816 4.73538
59 3HGM ATP 0.00005962 0.4837 4.7619
60 1I1E DM2 0.02042 0.40845 4.77137
61 3LRE ADP 0.002558 0.46304 4.78873
62 2C5S AMP 0.0000006767 0.62817 4.84262
63 4TR9 38D 0.02545 0.40607 4.87805
64 2WE0 UMP 0.01555 0.40604 4.8951
65 1O97 AMP 0.0005904 0.48254 4.92424
66 1O94 AMP 0.0005836 0.45073 4.92424
67 3IT7 TLA 0.02248 0.40737 4.94506
68 4B47 GDP 0.01138 0.41698 4.95868
69 1TV5 ORO 0.004716 0.44388 4.96614
70 2NCD ADP 0.006085 0.43861 5
71 4L2I NAD 0.0008279 0.46657 5.20231
72 4L2I FAD 0.0005393 0.46467 5.20231
73 3LGS ADE 0.005776 0.43857 5.24345
74 3LGS SAH 0.01048 0.41037 5.24345
75 2OQ2 A3P 0.00005888 0.48392 5.36398
76 1Y63 ADP 0.01411 0.40811 5.43478
77 3WMX THR 0.01184 0.41919 5.58659
78 3B9Q MLI 0.002054 0.46564 5.62914
79 1GOJ ADP 0.002758 0.46059 5.6338
80 4YDS ATP 0.006963 0.43256 5.70175
81 1GPM AMP 0.0001899 0.50108 5.76541
82 2BOS GLA GAL GLC 0.0001377 0.52823 5.88235
83 2BOS GLA GAL GLC NBU 0.0001563 0.52453 5.88235
84 3MD0 GDP 0.01135 0.41703 5.91549
85 1W7J ADP BEF 0.00608 0.40997 5.96026
86 2IYL GDP 0.009679 0.41613 5.98592
87 2AWN ADP 0.0002901 0.51472 6.03675
88 2ED4 NAD 0.02069 0.41015 6.04027
89 1G7S GDP 0.01142 0.40858 6.16302
90 4FFG 0U8 0.02579 0.40763 6.30081
91 1XNG ATP 0.000004654 0.54188 6.34328
92 5GOE GDP 0.005585 0.41926 6.3981
93 2V5K OXM 0.02723 0.40818 6.62021
94 2CBZ ATP 0.002549 0.4531 6.75944
95 3OQJ 3CX 0.01288 0.41005 7.393
96 5H67 ATP 0.0151 0.40278 7.5
97 3TK1 GDP 0.01166 0.42103 7.57576
98 2BSA FAD 0.01701 0.41061 7.59076
99 2BSA NAP 0.01765 0.41061 7.59076
100 5TWJ SAM 0.00251 0.41036 8.02469
101 3FIU POP 0.00001277 0.58585 8.03213
102 3FIU AMP 0.000116 0.50979 8.03213
103 3KTA AP5 0.005364 0.41613 8.09249
104 4YMU ATP 0.006593 0.42887 8.18182
105 3GYQ SAM 0.002406 0.42399 8.45588
106 2QN6 GDP 0.0152 0.41067 8.60215
107 1YRO UDP 0.02419 0.41345 8.94309
108 1QKQ MAN 0.03177 0.40361 9.15493
109 2YY8 MTA 0.009794 0.41177 9.45274
110 2B4G ORO 0.01483 0.41564 9.46372
111 1JJ7 ADP 0.0006806 0.48869 9.61539
112 1MJH ATP 0.00008673 0.47691 9.87654
113 3PQC GDP 0.01419 0.41663 10.7692
114 4CVN ADP 0.01585 0.41415 10.9489
115 1SM4 FAD 0.007118 0.41054 12.5
116 1G6H ADP 0.000571 0.48942 12.8405
117 1KK8 BEF ADP 0.001716 0.4344 12.9496
118 2GDJ ANP 0.007997 0.42018 14.0152
119 4BQS ADP 0.01071 0.41399 14.7727
120 5UDS ATP 0.0000003883 0.63034 17.1329
121 1GRN AF3 0.01587 0.41411 17.801
122 2VOH CIT 0.007197 0.44656 26.9231
123 1CT9 AMP 0.0000001727 0.516 30.4175
124 1JGT CMA 0.000000002152 0.57428 35.3877
125 1JGT APC 0.000000002257 0.56477 35.3877
Pocket No.: 3; Query (leader) PDB : 1Q19; Ligand: APC; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 3) in the query (biounit: 1q19.bio1) has 23 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 1Q19; Ligand: SSC; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 4) in the query (biounit: 1q19.bio1) has 10 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 5; Query (leader) PDB : 1Q19; Ligand: APC; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 5) in the query (biounit: 1q19.bio1) has 23 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 6; Query (leader) PDB : 1Q19; Ligand: SSC; Similar sites found: 150
This union binding pocket(no: 6) in the query (biounit: 1q19.bio1) has 12 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1ZOA 140 0.006573 0.45533 1.05708
2 2WOX NDP 0.03416 0.41177 1.22699
3 4PFO ADP 0.02645 0.41058 1.39165
4 5JCM NAD 0.03746 0.42788 1.55211
5 5JCM FAD 0.03666 0.42788 1.55211
6 5JCM ISD 0.03746 0.42788 1.55211
7 1QO8 FAD 0.02108 0.43273 1.59046
8 1KC7 PPR 0.004096 0.42815 1.59046
9 2RGO FAD 0.0292 0.41638 1.59046
10 2RGH FAD 0.03587 0.41561 1.59046
11 2VVM FAD 0.01494 0.43935 1.61616
12 2D4V NAD 0.04291 0.40055 1.6317
13 1BXK NAD 0.04373 0.40051 1.69014
14 2XVF FAD 0.03533 0.41527 1.72414
15 1V8B NAD 0.009679 0.44209 1.87891
16 2J5V PCA 0.006518 0.41773 1.90736
17 5WRJ A3P 0.00432 0.45421 1.9802
18 2DKH FAD 0.04518 0.40785 1.98807
19 4A0M NAD 0.01912 0.42672 2.01613
20 2CWH PYC 0.00633 0.45567 2.04082
21 2CWH NDP 0.005142 0.45567 2.04082
22 3PE2 E1B 0.03484 0.4173 2.07715
23 1V59 FAD 0.03477 0.42208 2.09205
24 1H82 GZZ 0.03898 0.42641 2.11864
25 1H82 FAD 0.04108 0.4232 2.11864
26 4K38 SAM 0.01596 0.41174 2.16216
27 4K39 SAM 0.01807 0.40628 2.16216
28 1Q3Q ANP 0.005107 0.44938 2.18688
29 1GSA ADP 0.006882 0.43801 2.21519
30 3CIF NAD 0.01312 0.43046 2.22841
31 4PFW MAN MAN BMA BMA BMA BMA 0.01174 0.43837 2.38569
32 4BV6 FAD 0.01644 0.43678 2.43408
33 4USQ FAD 0.03485 0.41325 2.49307
34 1KOL NAD 0.02853 0.42023 2.51256
35 2F5Z FAD 0.04953 0.41258 2.53165
36 1GQG DCD 0.0298 0.40354 2.57143
37 4MIG G3F 0.01906 0.43749 2.58449
38 1N4W FAD 0.0479 0.41325 2.58449
39 1VBH PEP 0.01027 0.4054 2.58449
40 3OTX AP5 0.04248 0.40488 2.59366
41 4C12 ADP 0.03168 0.43101 2.59481
42 2JG1 ANP 0.02957 0.40272 2.72727
43 1MV8 NAD 0.0165 0.41864 2.75229
44 3HQP FDP 0.01577 0.4054 2.80561
45 3CTY FAD 0.02874 0.42432 2.82132
46 4DV8 0LX 0.02688 0.4211 2.98211
47 3ICT ADP 0.01197 0.4125 2.98211
48 4BVA NDP 0.006202 0.45344 2.98507
49 3N0S ACO 0.0349 0.41672 2.98507
50 4OKZ 3E9 0.01076 0.42617 3.0137
51 1YKD CMP 0.02013 0.40199 3.01508
52 3CV6 NAP 0.04468 0.40906 3.09598
53 3CV6 HXS 0.04627 0.40906 3.09598
54 2V3A FAD 0.02811 0.4238 3.125
55 1LDN NAD 0.02333 0.41941 3.16456
56 4FWE FAD 0.02879 0.42406 3.18091
57 3ZL8 ADP 0.01746 0.41143 3.20366
58 1SC6 NAD 0.02709 0.41354 3.21782
59 1YKI NFZ 0.008244 0.44826 3.22581
60 4RGQ NDP 0.04464 0.40175 3.26087
61 1CX4 CMP 0.01351 0.41584 3.27869
62 2PZM NAD 0.04796 0.41234 3.33333
63 2PZM UDP 0.04796 0.41234 3.33333
64 1UOU CMU 0.01533 0.40267 3.37553
65 2E5V FAD 0.04002 0.42033 3.38983
66 4B7P 9UN 0.0435 0.4144 3.47826
67 5N5D SAM 0.01517 0.41064 3.53982
68 1YKJ FAD 0.04025 0.42663 3.5533
69 3LOO B4P 0.001401 0.48801 3.56164
70 1RSG FAD 0.03345 0.42097 3.57853
71 1ZCB GDP 0.0257 0.41256 3.59116
72 1YY5 FAD 0.04176 0.41653 3.77734
73 5E5U MLI 0.00122 0.46016 3.78788
74 1RP0 AHZ 0.005121 0.45701 3.87324
75 1E6E FAD 0.01674 0.43334 3.90625
76 5EP2 AZU 0.0175 0.40816 3.90625
77 1XPJ TLA 0.0009898 0.45559 3.96825
78 4HIA FMN 0.03128 0.41544 3.97727
79 3FMI KAP 0.00636 0.43841 3.98406
80 4ZGS NAD 0.009257 0.43292 4.14508
81 2H04 4UN 0.02635 0.4013 4.15335
82 1PJS NAD 0.0176 0.41357 4.15755
83 1DXY NAD 0.0227 0.41308 4.2042
84 3G6K POP 0.04682 0.40128 4.22078
85 4KQW NAP 0.02023 0.42388 4.28571
86 3L0E G58 0.02158 0.41848 4.34783
87 1V9N NDP 0.04854 0.4037 4.44444
88 3DUW SAH 0.01422 0.41277 4.4843
89 4CNK FAD 0.03647 0.41843 4.60358
90 3H4L ANP 0.009471 0.42811 4.63215
91 1NMU MTT 0.01349 0.41421 4.71204
92 4AT0 FAD 0.01334 0.44784 4.77137
93 1GAD NAD 0.02093 0.41694 4.84848
94 4TQG NDP 0.0127 0.43248 4.95356
95 4TM3 FAD 0.02383 0.44092 4.96614
96 2GAG FOA 0.03669 0.42024 5.05051
97 2GAG FAD 0.03669 0.42024 5.05051
98 2NAD NAD 0.04733 0.40256 5.08906
99 1GR0 NAD 0.03017 0.41461 5.17711
100 2O4C NAD 0.01187 0.43287 5.26316
101 5BV6 35G 0.007132 0.43233 5.26316
102 1NE6 SP1 0.005313 0.43539 5.30035
103 3HRD FAD 0.0213 0.43076 5.41176
104 1RYI FAD 0.02829 0.42342 5.49738
105 2RJH DCS 0.01843 0.40038 5.5409
106 5FJJ MAN 0.002627 0.46522 5.5666
107 1EBF NAD 0.004375 0.44857 5.58659
108 3WMX THR 0.01225 0.40282 5.58659
109 3UPY FOM 0.004244 0.41991 5.61798
110 1OMO NAD 0.00534 0.44774 5.90062
111 2AWN ADP 0.01078 0.40414 6.03675
112 1RC0 KT5 0.04474 0.40893 6.2201
113 1I8T FAD 0.02769 0.42628 6.26703
114 1W78 ADP 0.004514 0.45054 6.3981
115 1W78 PD8 0.00973 0.45036 6.3981
116 1REO FAD 0.0319 0.41805 6.79012
117 1OE0 TTP 0.02436 0.41469 6.95652
118 3FHI ANP 0.01904 0.41483 7.14286
119 3I59 N6S 0.006536 0.43689 7.22892
120 3I54 CMP 0.008827 0.4248 7.22892
121 3I59 N6R 0.02034 0.40962 7.22892
122 5N7O 69Y 0.02847 0.40022 7.23982
123 1KZN CBN 0.007451 0.42846 7.31707
124 1GUZ NAD 0.01907 0.42376 7.41935
125 1U0J ADP 0.004878 0.4263 7.49064
126 5GM9 CBK 0.009475 0.44342 7.51174
127 1N62 FAD 0.01604 0.43034 7.55467
128 4C3Y ANB 0.03638 0.42684 7.55467
129 5KBF CMP 0.008131 0.42488 7.6412
130 9LDT NAD 0.01216 0.4354 7.83133
131 3WIS FMN 0.02144 0.41561 8.0402
132 5HES 032 0.02727 0.40647 8.46906
133 2DC1 NAD 0.01543 0.4247 8.8983
134 3TTZ 07N 0.01404 0.40368 9.09091
135 1J0X NAD 0.02173 0.43281 9.63855
136 3NC9 TR3 0.01203 0.43577 9.90415
137 5N2I NAP 0.01454 0.42055 10.3448
138 5C8W PCG 0.006193 0.42206 11.1888
139 3ZIA ADP 0.01034 0.41691 11.5108
140 1KQN NAD 0.02921 0.41091 11.828
141 2DFV NAD 0.01975 0.4207 12.3919
142 5GRF ADP 0.04048 0.40347 12.9944
143 3FRK TQP 0.01413 0.43265 13.6729
144 4GGL CJC 0.007997 0.42103 16.2791
145 1OFH ADP 0.01675 0.40681 16.4516
146 2B6N ALA PRO THR 0.01334 0.40125 17.9856
147 4XB2 NDP 0.0251 0.40786 19.1045
148 4XB2 HSE 0.0379 0.40786 19.1045
149 4UP3 FAD 0.006651 0.45672 22.293
150 3I5C C2E 0.001431 0.44833 24.2718
Pocket No.: 7; Query (leader) PDB : 1Q19; Ligand: APC; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 7) in the query (biounit: 1q19.bio1) has 22 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 8; Query (leader) PDB : 1Q19; Ligand: SSC; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 8) in the query (biounit: 1q19.bio1) has 9 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
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