Receptor
PDB id Resolution Class Description Source Keywords
2QS8 2.33 Å EC: 3.-.-.- CRYSTAL STRUCTURE OF A XAA-PRO DIPEPTIDASE WITH BOUND METHIO THE ACTIVE SITE ALTEROMONAS MACLEODII AMIDOHYDROLASE DIPEPTIDASE TIM BARREL PROTEIN STRUCTURE INITIATIVE PSI-2 9355E NYSGXRC STRUCTURAL GENOMICS NEWRESEARCH CENTER FOR STRUCTURAL GENOMICS HYDROLASE
Ref.: FUNCTIONAL ANNOTATION OF TWO NEW CARBOXYPEPTIDASES AMIDOHYDROLASE SUPERFAMILY OF ENZYMES. BIOCHEMISTRY V. 48 4567 2009
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
MET A:600;
B:700;
Valid;
Valid;
none;
none;
submit data
149.211 C5 H11 N O2 S CSCC[...
MG A:500;
B:500;
Part of Protein;
Part of Protein;
none;
none;
submit data
24.305 Mg [Mg+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2QS8 2.33 Å EC: 3.-.-.- CRYSTAL STRUCTURE OF A XAA-PRO DIPEPTIDASE WITH BOUND METHIO THE ACTIVE SITE ALTEROMONAS MACLEODII AMIDOHYDROLASE DIPEPTIDASE TIM BARREL PROTEIN STRUCTURE INITIATIVE PSI-2 9355E NYSGXRC STRUCTURAL GENOMICS NEWRESEARCH CENTER FOR STRUCTURAL GENOMICS HYDROLASE
Ref.: FUNCTIONAL ANNOTATION OF TWO NEW CARBOXYPEPTIDASES AMIDOHYDROLASE SUPERFAMILY OF ENZYMES. BIOCHEMISTRY V. 48 4567 2009
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 218 families.
1 2QS8 - MET C5 H11 N O2 S CSCC[C@@H]....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 176 families.
1 2QS8 - MET C5 H11 N O2 S CSCC[C@@H]....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 143 families.
1 2QS8 - MET C5 H11 N O2 S CSCC[C@@H]....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: MET; Similar ligands found: 32
No: Ligand ECFP6 Tc MDL keys Tc
1 MET 1 1
2 MED 1 1
3 DBB 0.518519 0.655172
4 ABA 0.518519 0.655172
5 2FM 0.514286 0.666667
6 NVA 0.5 0.758621
7 MF3 0.5 0.647059
8 DAB 0.466667 0.636364
9 HSE 0.466667 0.617647
10 SME 0.457143 0.717949
11 MHO 0.457143 0.717949
12 HCS 0.451613 0.733333
13 API 0.451613 0.606061
14 CDT 0.447368 0.756757
15 2MM 0.444444 0.657143
16 NLE 0.441176 0.766667
17 ONL 0.441176 0.71875
18 UN1 0.428571 0.606061
19 11C 0.428571 0.606061
20 MSE 0.428571 0.9
21 GGL 0.424242 0.625
22 GLU 0.424242 0.625
23 DGL 0.424242 0.625
24 CBH 0.418605 0.685714
25 ORN 0.411765 0.65625
26 AME 0.410256 0.771429
27 FME 0.410256 0.84375
28 LEU 0.40625 0.666667
29 CYS 0.4 0.666667
30 C2N 0.4 0.633333
31 DCY 0.4 0.666667
32 JM6 0.4 0.7
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2QS8; Ligand: MET; Similar sites found: 399
This union binding pocket(no: 1) in the query (biounit: 2qs8.bio1) has 15 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1UO5 PIH 0.001955 0.50242 None
2 4Q3F TLA 0.001129 0.46962 None
3 3ZZS TRP 0.0000002883 0.4644 None
4 3SJ0 DXC 0.01419 0.42414 None
5 2IYG FMN 0.004958 0.41416 None
6 4PNO U5P 0.008739 0.40044 None
7 2ZWS PLM 0.01874 0.44645 0.956938
8 4HE2 AMP 0.0001492 0.40772 1.19617
9 1WDA BAG 0.01235 0.40662 1.19617
10 4IVG ANP 0.00001841 0.47011 1.39104
11 4UAL 3FV 0.005464 0.40066 1.43541
12 1J2Z SOG 0.001304 0.42555 1.48148
13 2OWZ CIT 0.01105 0.42358 1.50602
14 2OWZ F6P 0.000004145 0.41438 1.50602
15 4MWV BCZ 0.0001062 0.4322 1.54639
16 3H86 AP5 0.0006867 0.41712 1.5625
17 3JQ3 ADP 0.004828 0.41909 1.63934
18 2ZI8 SDT 0.0001523 0.41575 1.66667
19 4JP3 CIT 0.005419 0.41262 1.67364
20 2YIV NBN 0.001158 0.47657 1.67464
21 4HA6 PXM 0.001093 0.46337 1.67464
22 2YP9 SIA CMO 0.001074 0.42867 1.67464
23 2YIV YIV 0.02927 0.41444 1.67464
24 2WYA HMG 0.02842 0.40902 1.67464
25 2CE7 ADP 0.01356 0.40373 1.67464
26 3ZGE ASP 0.04872 0.40319 1.67464
27 2F2U M77 0.003736 0.42364 1.74129
28 3ZPG 5GP 0.004932 0.46106 1.83246
29 2GGH NLQ 0.000007914 0.41787 1.86667
30 4WX0 HXD 0.004072 0.40919 1.90114
31 2IZ1 ATR 0.01269 0.42078 1.91388
32 3U1T MLI 0.01493 0.42307 1.94175
33 1WRA PC 0.005031 0.44587 1.94805
34 3BRE C2E 0.01402 0.41875 1.95531
35 4C6F NCD 0.003785 0.42342 2.03562
36 4C6F DOR 0.003785 0.42342 2.03562
37 2CWH NDP 0.0333 0.40306 2.04082
38 1E2S CSN 0.003366 0.41645 2.04499
39 1Z6K OAA 0.0004308 0.45906 2.04778
40 4HZX G39 0.0004963 0.41449 2.06186
41 1K27 MTM 0.00009664 0.40996 2.12014
42 2Q3M MLA 0.01704 0.43296 2.14724
43 3FPZ AHZ 0.00000843 0.50314 2.15311
44 1VCO GLN 0.000003862 0.4707 2.15311
45 1KC7 PPR 0.005106 0.44557 2.15311
46 2YYJ FAD 0.0007959 0.4375 2.15311
47 2YYJ 4HP 0.0007959 0.4375 2.15311
48 2NCD ADP 0.005491 0.4319 2.15311
49 4A3R CIT 0.0000129 0.42097 2.15311
50 2W8Q SIN 0.03205 0.40694 2.15311
51 2NLI FMN 0.00002697 0.46488 2.17391
52 2NLI LAC 0.00002697 0.46488 2.17391
53 1G8S MET 0.003509 0.44675 2.17391
54 4N02 FNR 0.00001148 0.47879 2.2409
55 1ML4 PAL 0.00008413 0.44066 2.27273
56 5EQU AKG 0.01651 0.42699 2.29508
57 1IZC PYR 0.002176 0.4006 2.35988
58 1Z42 HBA 0.00115 0.51891 2.36686
59 1RZM E4P 0.01835 0.41873 2.36686
60 1JQN DCO 0.0000001482 0.4774 2.39234
61 1V5F FAD 0.0009543 0.45689 2.39234
62 1V5F TPP 0.0009543 0.45689 2.39234
63 4LHM AZZ 0.0114 0.41762 2.39234
64 4CCO OGA 0.00956 0.41602 2.39234
65 2OI2 DP6 0.0093 0.40948 2.39726
66 1NML CIT 0.003698 0.43398 2.45399
67 1NNS ASP 0.003339 0.42564 2.45399
68 2VQ5 LDP 0.0417 0.41248 2.48756
69 2VQ5 HBA 0.03043 0.40804 2.48756
70 1O68 KIV 0.0142 0.40023 2.54545
71 1JA9 NDP 0.000005797 0.50203 2.55474
72 1JA9 PYQ 0.000003645 0.46219 2.55474
73 2IMP NAI 0.00005603 0.4753 2.63158
74 3L24 GOA 0.01129 0.44231 2.63158
75 4DYO SD4 0.0151 0.40293 2.63158
76 1FS5 TLA 0.0007753 0.40007 2.63158
77 1I0Z OXM 0.02066 0.42857 2.7027
78 3O03 NAP 0.0001368 0.44826 2.74914
79 4NAO AKG 0.01305 0.4259 2.76074
80 4CMF PXG 0.000009851 0.4787 2.79503
81 1OTH PAO 0.0002334 0.41507 2.80374
82 4COQ SAN 0.005771 0.43671 2.83401
83 1I9G SAM 0.0000226 0.46276 2.85714
84 3VOZ 04A 0.002671 0.41203 2.85714
85 1HG4 LPP 0.01319 0.42134 2.86738
86 3MAG 3MA 0.0144 0.44439 2.87081
87 1FA2 DOM 0.00003276 0.43487 2.87081
88 3RF4 FUN 0.005905 0.42514 2.87081
89 2VAR AMP 0.0054 0.4171 2.8754
90 2VAR ANP 0.0009693 0.41591 2.8754
91 2VAR KDF 0.007259 0.40758 2.8754
92 3CXO 1N5 0.000007319 0.45722 2.89157
93 3CXO 3LR 0.00004471 0.431 2.89157
94 2DWU DGL 0.005704 0.4208 2.89855
95 3VCA PRO 0.001512 0.45389 2.91262
96 1JN2 SFP 0.006151 0.40634 2.95359
97 4L3L 5FI 0.02741 0.40748 2.96053
98 1GPJ CIT 0.00232 0.4551 2.9703
99 4B16 NAG 0.0133 0.44627 3.00752
100 4IU0 ABH 0.001931 0.40232 3.0303
101 4QA8 PJZ 0.01808 0.41001 3.05677
102 2BZ1 TAU 0.004703 0.48073 3.06122
103 1T26 GBD 0.0002771 0.45904 3.10559
104 1T26 NAI 0.0002771 0.45904 3.10559
105 2Z5Y HRM 0.00006851 0.42569 3.11005
106 2OAT PFM 0.00558 0.40033 3.11005
107 1B74 DGN 0.007275 0.44485 3.14961
108 4F07 FAD 0.02307 0.40153 3.15789
109 1GSA ADP 0.000005486 0.48436 3.16456
110 1GSA GSH 0.0001373 0.43384 3.16456
111 3L6R MLI 0.004803 0.44684 3.17919
112 4DN8 BMA 0.0001389 0.51183 3.20513
113 3PHQ KDO 0.03215 0.43932 3.22581
114 3CQ5 PMP 0.002789 0.4339 3.25203
115 2WL9 MBD 0.000007095 0.47231 3.27869
116 2OVD DAO 0.009844 0.41048 3.2967
117 1UAY ADN 0.004552 0.41139 3.30579
118 4MOB ADP 0.001328 0.42525 3.31325
119 3L02 SN0 0.0000571 0.41551 3.34262
120 3L02 CP 0.0000571 0.41551 3.34262
121 4C2G ALA ALA ALA ALA 0.0003959 0.46958 3.34928
122 3NOJ PYR 0.0001414 0.49929 3.36134
123 3OIG NAD 0.00003507 0.46919 3.38346
124 3OIG IMJ 0.0001319 0.4238 3.38346
125 3S9K CIT 0.004415 0.48655 3.38983
126 1D3V ABH 0.0002644 0.40081 3.40557
127 2JFV FLC 0.01119 0.42332 3.43643
128 2Q8H TF4 0.005173 0.45998 3.4398
129 1KTC NGA 0.005787 0.42552 3.45679
130 2TOH HBI 0.0002195 0.42548 3.49854
131 1Y2W NAG 0.01258 0.42096 3.52113
132 3K3G MMU 0.0002806 0.48616 3.52941
133 3MB5 SAM 0.00006158 0.45355 3.52941
134 1O6B ADP 0.000428 0.42198 3.5503
135 1TV5 ORO 0.0000121 0.50073 3.58852
136 1Q3Q ANP 0.000006197 0.49159 3.58852
137 2C5S AMP 0.001973 0.44023 3.58852
138 1Z45 GAL 0.003494 0.43505 3.58852
139 4RJK PYR 0.01606 0.4276 3.58852
140 3O2K DST 0.00537 0.42693 3.58852
141 4M5P 23W 0.03291 0.41186 3.58852
142 4A8H PUW 0.0002316 0.40404 3.58852
143 1TV5 A26 0.002022 0.40166 3.58852
144 2ZJF BSU 0.002596 0.43011 3.59116
145 1DXY COI 0.03713 0.41515 3.6036
146 2FGQ MLT 0.00007483 0.52429 3.61446
147 1JGS SAL 0.04668 0.42359 3.62319
148 3NJQ NJQ 0.00001922 0.4498 3.62694
149 4Q3S X7A 0.0004723 0.4115 3.63636
150 4IEN COA 0.0000478 0.41612 3.68098
151 4IEN GDP 0.000589 0.40361 3.68098
152 4P87 4NP 0.00005046 0.43723 3.74065
153 1QZZ SAM 0.003636 0.41515 3.74332
154 1OMZ UD2 0.0003711 0.42284 3.75427
155 1JAC AMG 0.005247 0.46827 3.7594
156 1F8F NAD 0.0001985 0.44126 3.77358
157 3GM5 CIT 0.006306 0.43492 3.77358
158 1MVQ MMA 0.000002502 0.45667 3.81356
159 1Y1A GSH 0.04335 0.42057 3.82514
160 3F81 STT 0.03092 0.41936 3.82514
161 2Z9V PXM 0.004074 0.43215 3.82653
162 3QV9 QV7 0.01191 0.41676 3.82775
163 3I0O ADP 0.00803 0.41004 3.83481
164 2NZ2 ASP 0.0007575 0.46388 3.87409
165 2NZ2 CIR 0.0004234 0.40953 3.87409
166 3TFC PEP 0.002443 0.4418 3.8961
167 2X2T GAL NGA 0.02398 0.42517 3.92157
168 2P69 PLP 0.008383 0.42363 3.92157
169 1D09 PAL 0.01315 0.40499 3.92157
170 1EYE PMM 0.004686 0.41513 3.92857
171 3WCS MAN NAG 0.006228 0.42413 3.93701
172 3WCS MAN NAG GAL 0.007553 0.41113 3.93701
173 3TO7 COA 0.0009489 0.40481 3.98551
174 2H6B 3C4 0.0001189 0.4484 4
175 1LYX PGA 0.006839 0.40456 4.03226
176 3P7I P7I 0.003343 0.43588 4.04984
177 1T10 F6P 0.005322 0.43251 4.06699
178 4PB2 5UD 0.0008842 0.42527 4.06699
179 1LTH NAD 0.00008399 0.4513 4.07523
180 4JEJ 1GP 0.002955 0.42308 4.09836
181 1Q6O LG6 0.003489 0.41171 4.16667
182 2J5S KTA 0.003264 0.40508 4.18251
183 4L2I FAD 0.04406 0.40314 4.18251
184 1T0I FMN 0.003342 0.40472 4.18848
185 3CF6 SP1 0.007087 0.40014 4.19162
186 4JWX 1N4 0.01842 0.40358 4.28571
187 4OE4 NAD 0.0002075 0.40572 4.30622
188 2CJH AKG 0.005344 0.40475 4.30622
189 2XI7 XI7 0.02144 0.44309 4.34783
190 1ONX ASP 0.00004762 0.43799 4.35897
191 1YBQ BDH 0.0000153 0.41799 4.35897
192 1A8S PPI 0.003761 0.42119 4.3956
193 2B7N NTM 0.01564 0.41143 4.3956
194 4EKV BTN 0.000008752 0.45841 4.40252
195 9LDT OXM 0.02721 0.42924 4.51807
196 9LDB OXM 0.04568 0.41682 4.51807
197 3IB9 BTN 0.002361 0.4654 4.54545
198 2D0V PQQ 0.001296 0.41542 4.54545
199 3PNA CMP 0.01049 0.40963 4.54545
200 1EB9 HBA 0.01096 0.40045 4.58015
201 4USS GSH 0.01872 0.40327 4.61538
202 4Q0A 4OA 0.003059 0.40609 4.63576
203 4FUA PGH 0.0007382 0.40229 4.65116
204 1PEA ACM 0.006704 0.44663 4.67532
205 1QO0 BMD 0.03493 0.40015 4.67532
206 2GN2 C5P 0.00003094 0.48271 4.67836
207 1A5Z OXM 0.0001826 0.52479 4.70219
208 1A5Z FBP 0.00002626 0.47409 4.70219
209 1SAZ ACP 0.00378 0.41222 4.72441
210 1UOU CMU 0.002236 0.4233 4.78469
211 4NVP 7CH 0.00005687 0.40159 4.78469
212 1P72 THM 0.02181 0.40036 4.79042
213 3UEC ALA ARG TPO LYS 0.01398 0.42446 4.79452
214 1NF8 BOG 0.01087 0.42973 4.83092
215 1NF8 ISC 0.006717 0.40892 4.83092
216 3CL7 HYN 0.0000538 0.41671 4.87013
217 3DX5 DHB 0.005334 0.41732 4.8951
218 4W6Z ETF 0.01925 0.43018 4.89914
219 1CBF SAH 0.004159 0.40885 4.91228
220 1YOE RIB 0.000006852 0.45434 4.96894
221 4U36 TNR 0.000003526 0.44674 5
222 3Q3C NAD 0.0002467 0.43641 5.01672
223 3SHR CMP 0.002395 0.43154 5.01672
224 2JE7 XMM 0.0003196 0.40129 5.02092
225 4AF0 MOA 0.00001544 0.4617 5.02392
226 4KCF FMN 0.00006561 0.43847 5.02392
227 1GJW GLC 0.01227 0.4272 5.02392
228 4KCF AKM 0.001247 0.41227 5.02392
229 4AF0 IMP 0.000002118 0.40189 5.02392
230 3RK0 AMP 0.005727 0.41167 5.06329
231 4LTN FMN 0.00003469 0.4546 5.07614
232 4LTN NAI 0.001163 0.41141 5.07614
233 1NU4 MLA 0.004404 0.42554 5.15464
234 4LIT AKG 0.01133 0.41774 5.15971
235 1RYD GLC 0.02983 0.40338 5.16796
236 4QCK ASD 0.00008315 0.43465 5.18135
237 1T3D CYS 0.009512 0.43253 5.19031
238 1I2B USQ 0.0002424 0.4721 5.19802
239 1I2B NAD 0.0002424 0.4721 5.19802
240 1I2B UPG 0.0002424 0.4721 5.19802
241 3UXL CFI 0.0000007271 0.42804 5.22193
242 1WGC SIA GAL BGC 0.03609 0.42249 5.26316
243 3T1A 5MA 0.002711 0.40796 5.26316
244 2VDJ HSE 0.04248 0.40622 5.31561
245 4EKQ NPO 0.01326 0.40827 5.34759
246 1XX4 BAM 0.005179 0.43028 5.36398
247 1Q11 TYE 0.01907 0.40292 5.37634
248 2JGS BTN 0.01956 0.40469 5.38462
249 2Y0I AKG 0.01086 0.41857 5.39773
250 1XE7 GUN 0.03379 0.41732 5.41872
251 4TSK NDP 0.0005438 0.42893 5.42857
252 1P9B HDA 0.001759 0.4541 5.42986
253 4B7E OGA 0.005214 0.43291 5.44413
254 2WA4 069 0.005888 0.41119 5.44413
255 1H2K OGA 0.02155 0.41002 5.44413
256 2Q1A 2KT 0.00004723 0.45546 5.46075
257 3TKA CTN 0.04629 0.43204 5.4755
258 4WBD CIT 0.03569 0.41007 5.50239
259 1RY2 AMP 0.0001504 0.40708 5.50239
260 1N9L FMN 0.002387 0.40992 5.50459
261 2YLD CMO 0.0129 0.42044 5.51181
262 2QLX RM4 0.008205 0.43563 5.55556
263 2P41 G1G 0.014 0.40432 5.57377
264 1QH9 LAC 0.0197 0.41185 5.60345
265 2OFE NAG 0.00454 0.44156 5.6338
266 2OFD NGA 0.005267 0.43856 5.6338
267 1C3V PDC 0.02773 0.40015 5.71429
268 1Y9Q MED 0.00009409 0.51967 5.72917
269 1EDO NAP 0.00002833 0.47916 5.7377
270 3A1I UNU 0.001322 0.44208 5.74163
271 3TA2 AKG 0.00003993 0.43241 5.74163
272 3A8U PLP 0.00007201 0.41293 5.74163
273 2BGM NAJ 0.00005586 0.4608 5.7554
274 1H2M OGA 0.02073 0.4108 5.76923
275 3M0J OAF 0.008351 0.4006 5.86319
276 1SS4 GSH 0.004575 0.48696 5.88235
277 2A0W DIH 0.00005578 0.41043 5.88235
278 1Y75 NAG 0.001812 0.44178 5.9322
279 1FBL HTA 0.01037 0.40548 5.94595
280 2Y7P SAL 0.00623 0.42412 5.9633
281 3GTD MLI 0.002903 0.44433 5.98086
282 4LKK SIA GAL 0.0003434 0.43987 6.05096
283 3I8T LBT 0.000009645 0.54613 6.09756
284 4TMK T5A 0.00004003 0.49567 6.10329
285 2FR6 URI 0.000916 0.42472 6.16438
286 2FR6 CTN 0.003544 0.40381 6.16438
287 1SQ5 PAU 0.008967 0.41723 6.16883
288 1SQ5 ADP 0.01099 0.4004 6.16883
289 1O7N IND 0.0003061 0.4287 6.18557
290 1A5V Y3 0.003231 0.44224 6.32911
291 2EB5 OXL 0.01057 0.42448 6.36704
292 2DVZ GLU 0.005856 0.41566 6.36943
293 1FX8 BOG 0.00003446 0.481 6.40569
294 1ZFJ IMP 0.000231 0.4629 6.45933
295 2VG1 FPP 0.004505 0.44059 6.57895
296 4F4S EFO 0.01686 0.40526 6.57895
297 3EW2 BTN 0.001514 0.44506 6.66667
298 3NNF AKG 0.01924 0.41233 6.68605
299 1N6B DMZ 0.0000005465 0.44352 6.69856
300 4G1V FAD 0.001263 0.43667 6.69856
301 3NCQ ATP 0.001629 0.40828 6.72269
302 2RHQ GAX 0.001698 0.40416 6.80272
303 4EXO PYR 0.0004718 0.50421 6.84932
304 1B5E DCM 0.01625 0.40158 6.91057
305 2V5E SCR 0.0357 0.42275 6.93069
306 1K97 ASP 0.04344 0.40539 6.9378
307 1K97 CIR 0.04344 0.40539 6.9378
308 4KGM ATP 0.002095 0.42901 6.93878
309 3B9Z CO2 0.00005472 0.53059 6.95876
310 2X61 NGA GAL SIA 0.000009432 0.48571 6.97674
311 2X61 CH 0.00004946 0.44484 6.97674
312 1YGC 905 0.003263 0.4015 7.08661
313 3QP6 HL6 0.003364 0.41646 7.16981
314 2ZO9 MLI 0.00002025 0.51247 7.29927
315 1F5F DHT 0.002663 0.41207 7.31707
316 3DGB MUC 0.01017 0.40174 7.32984
317 3KJQ B94 0.008325 0.40521 7.36842
318 4G28 0W8 0.0002004 0.48202 7.38255
319 1JSH SIA GAL 0.001446 0.40646 7.38636
320 1LNX URI 0.01215 0.41148 7.40741
321 5DTF 5CT 0.01668 0.43002 7.47664
322 5DS8 GLY 5CT GLY ALA 0.04009 0.4075 7.47664
323 1UGX GAL MGC 0.00009621 0.42147 7.5188
324 4GQB 0XU 0.00000847 0.483 7.6555
325 2BO4 FLC 0.02013 0.41678 7.80856
326 1H16 PYR 0.001763 0.47563 7.89474
327 2ET1 GLV 0.000007861 0.41635 7.9602
328 1MXI SAH 0.002469 0.4094 8.125
329 2BLE 5GP 0.000002182 0.50832 8.17439
330 3T2W BTN 0.009744 0.4066 8.19672
331 3KYF 5GP 5GP 0.004496 0.42036 8.22511
332 3QDW A2G 0.003365 0.4697 8.39161
333 3QDY A2G GAL 0.0035 0.46075 8.39161
334 3QDW NDG 0.004196 0.44967 8.39161
335 3QDY CBS 0.004666 0.44745 8.39161
336 3QDT A2G GAL 0.007284 0.44483 8.39161
337 1S8F GDP 0.005404 0.40851 8.47458
338 1OFH ADP 0.0002377 0.40126 8.62069
339 1R0X ATP 0.00007487 0.43103 8.74126
340 3HRD FAD 0.04179 0.40986 8.75
341 3I6B KDO 0.003373 0.43571 8.88889
342 1X8X TYR 0.00691 0.41272 9.00621
343 1SC3 MLI 0.02413 0.41868 9.09091
344 3BY8 MLT 0.003505 0.45343 9.15493
345 2GJ3 FAD 0.0001113 0.46383 9.16667
346 1I2L DCS 0.001951 0.40925 9.29368
347 4C25 13P 0.00003087 0.43561 9.43396
348 1WNG SAH 0.0008108 0.42247 9.43396
349 4M7F BM3 0.0006344 0.46723 9.73451
350 1UQX MMA 0.00000237 0.45342 9.73451
351 1Y0L HAN 0.01708 0.44034 9.73451
352 1T0S BML 0.009347 0.4394 10.0478
353 1K6M AGS 0.002209 0.40381 10.0478
354 2C2A ADP 0.001299 0.42346 10.0775
355 1WKL ADP 0.0006013 0.43122 10.219
356 4N7C AEF 0.01464 0.42347 10.2273
357 2QUN FUD 0.00864 0.41543 10.3448
358 1XPM HMG 0.005095 0.44396 10.3535
359 1QDS PGA 0.000199 0.47565 10.3586
360 2HMT NAI 0.00003063 0.46094 10.4167
361 4LO6 SIA GAL 0.0006987 0.49131 10.5263
362 3LTW HLZ 0.000837 0.47565 10.7143
363 4CO3 ATP 0.000006816 0.40342 10.7143
364 1C1L GAL BGC 0.03173 0.40715 10.9489
365 3PMD 11A 0.01041 0.40542 11.1111
366 4WVH ASP HIS ASP ALA HIS ALA 0.005788 0.42053 11.244
367 1LDM OXM 0.00003314 0.50742 11.2462
368 1JOT GAL A2G 0.00005999 0.49691 11.2782
369 1BTN I3P 0.005733 0.48224 11.3208
370 1FWE HAE 0.0006847 0.45957 11.3208
371 1OGD RIP 0.008756 0.41769 11.4504
372 4C2W ANP 0.006137 0.41576 11.5385
373 3AD8 NAD 0.03792 0.40562 12.1212
374 2P8O BVA 0.002099 0.41585 12.3711
375 2JBM SRT 0.01019 0.41092 12.3746
376 2ORV 4TA 0.001399 0.4002 12.3932
377 3VGL BGC 0.000002002 0.46965 12.4611
378 2QCX PF1 0.0004664 0.47995 12.5475
379 1NXJ GLV 0.001376 0.44682 12.5683
380 1NXJ TLA 0.001791 0.42045 12.5683
381 4FGC PQ0 0.0215 0.40517 12.7273
382 4I9A NCN 0.0001507 0.41588 12.8472
383 2HVK TBA 0.0001426 0.5113 12.9032
384 2WIC GNP 0.0008379 0.40891 13.1086
385 2E1A MSE 0.001849 0.44141 13.3333
386 1PTR PRB 0.004533 0.44806 14
387 2FWP ICR 0.00000947 0.46064 14.7541
388 2FWP CIT 0.00001962 0.44479 14.7541
389 2O66 FLC 0.008115 0.42427 14.8148
390 1XG4 ICT 0.02086 0.40034 14.9153
391 4AP9 1PS 0.00007687 0.45793 14.9254
392 4CCN OGA 0.007411 0.43166 17.1429
393 1Y7P RIP 0.02239 0.40923 18.3857
394 2DTJ THR 0.006492 0.41383 20.2247
395 1YOA FMN 0.01605 0.45031 20.7547
396 3IS2 FAD 0.03565 0.40029 24.026
397 4G4S LDZ 0.004184 0.4049 24.0566
398 3NGU ADP 0.003831 0.41428 27.1523
399 3P3N AKG 0.003828 0.445 40
Pocket No.: 2; Query (leader) PDB : 2QS8; Ligand: MET; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 2) in the query (biounit: 2qs8.bio3) has 14 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 2QS8; Ligand: MET; 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: 2qs8.bio3) has 15 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 2QS8; Ligand: MET; Similar sites found: 98
This union binding pocket(no: 4) in the query (biounit: 2qs8.bio2) has 14 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2BOI MFU 0.001038 0.45485 None
2 1YRX FMN 0.004786 0.40771 None
3 2PFC PLM 0.008928 0.40127 1.0929
4 1C0I FAD 0.001658 0.41042 1.37741
5 1C0I BE2 0.001658 0.41042 1.37741
6 1HZP DAO 0.0347 0.41732 1.49254
7 3UST FAD 0.002364 0.4151 1.49813
8 4K33 ACP 0.01898 0.40668 1.53846
9 1ZJ6 G3D 0.00336 0.41798 1.60428
10 2ZJ5 ADP 0.01625 0.40805 1.67464
11 2NVK NAP 0.01778 0.40165 1.67464
12 1V6A TRE 0.00256 0.44384 1.80723
13 4O8A 2OP 0.0177 0.42948 1.91388
14 2CWH PYC 0.02561 0.41774 2.04082
15 2FMD MAN MAN 0.0001002 0.40326 2.08333
16 3Q9T FAY 0.001446 0.40508 2.15311
17 4AMV F6R 0.004882 0.4034 2.15311
18 3I51 45C 0.008213 0.4027 2.22222
19 1Z44 NPO 0.02261 0.43922 2.36686
20 4LCQ URQ 0.00001761 0.43674 2.39234
21 1YBH P22 0.01057 0.40246 2.54237
22 1XIU REA 0.0007205 0.42965 2.6087
23 2IMP LAC 0.000008353 0.43439 2.63158
24 2HEK GDP 0.01046 0.40263 2.69542
25 1AUA BOG 0.01681 0.40271 2.7027
26 3O03 GCO 0.000001535 0.4284 2.74914
27 4N69 SER 0.01305 0.41754 2.7972
28 2Y7G AAE 0.002825 0.41223 2.83688
29 2RIO ADP 0.01563 0.40718 2.87081
30 1Y42 TYR 0.003107 0.43436 3.06122
31 1RRC ADP 0.0001531 0.40502 3.32226
32 1FNZ A2G 0.00001064 0.47292 3.37553
33 2PP3 LGT 0.007544 0.40015 3.51759
34 4M5P MLA 0.004153 0.47093 3.58852
35 1TV5 N8E 0.0005002 0.43084 3.58852
36 4M5P FMN 0.0227 0.40607 3.58852
37 1H7F C5P 0.02096 0.40265 3.67347
38 3CEV ARG 0.01233 0.40398 3.67893
39 1A59 CIT 0.01779 0.41677 3.7037
40 4KCT PYR 0.003879 0.42499 3.82775
41 3I0O SMI 0.00391 0.43566 3.83481
42 3F8C HT1 0.001304 0.45688 3.96825
43 2W24 LYS 0.00006025 0.42153 4
44 3PLN U5P 0.009193 0.41404 4.06699
45 4HZO COA 0.01546 0.40427 4.08805
46 5DRN 5CT 0.03551 0.41695 4.16667
47 1V1A ADP 0.00007023 0.43293 4.20712
48 1XMV ADP 0.001044 0.42158 4.21348
49 2WLT ASP 0.0002021 0.4062 4.21687
50 1OJ4 ANP 0.01517 0.40784 4.30622
51 4EUU BX7 0.03304 0.40339 4.38871
52 3FS8 TDR 0.004778 0.41301 4.3956
53 3FS8 ACO 0.007647 0.4067 4.3956
54 1F7K UMP 0.0006099 0.41011 4.41176
55 3FHI ANP 0.03654 0.40107 4.54545
56 1QD0 RR6 0.004988 0.41123 4.6875
57 1E5F PLP 0.005605 0.40117 4.70297
58 1LCP PLU 0.0001473 0.41668 4.78469
59 3HZS M0E 0.001673 0.40633 4.78469
60 1E4E PHY 0.003035 0.41107 4.95627
61 3R51 MMA 0.03646 0.41309 5
62 1QM5 GLC GLC GLC PO4 SGC GLC 0.04952 0.40213 5.02392
63 3SCH TB6 0.01046 0.42198 5.05051
64 3GGU 017 0.03067 0.40771 5.05051
65 1QY1 PRZ 0.001795 0.40385 5.17241
66 2QIA U20 0.00417 0.40288 5.34351
67 4WBD ADP 0.03906 0.40027 5.50239
68 1I1Q TRP 0.00319 0.42853 5.72917
69 3TA2 ATP 0.001065 0.40377 5.74163
70 1U5R ATP 0.002931 0.41163 5.74713
71 2BGM MAX 0.0003364 0.4024 5.7554
72 4OB6 S2T 0.002854 0.41206 5.8651
73 3GJB AKG 0.01183 0.40474 5.98086
74 2Q37 3AL 0.01773 0.40635 6.07735
75 4QDC ASD 0.0003255 0.40742 6.15385
76 3BHO B4P 0.02704 0.42687 6.73077
77 1JCM 137 0.00003171 0.42963 6.94981
78 43CA NPO 0.04309 0.42484 7.07965
79 3E81 SLB 0.01644 0.40782 7.31707
80 5DUB GLY 5GG GLY ALA 0.02306 0.42022 7.47664
81 4OYA 1VE 0.009288 0.41252 7.6555
82 1CFV E3G 0.0001281 0.42543 7.9646
83 1KDK DHT 0.001386 0.40402 8.47458
84 2ZSC BTN 0.007379 0.40052 8.51064
85 2JC9 ADN 0.003169 0.43399 8.85168
86 4LBP 1WG 0.00002249 0.43344 9
87 3E9I XAH 0.0379 0.404 9.80861
88 1WKL ATP 0.0002031 0.4446 10.219
89 1H8G CHT 0.01948 0.4429 10.5263
90 1ZZ7 S0H 0.006671 0.42006 12.1212
91 3EJ0 11X 0.002931 0.43828 12.2449
92 3VGL ANP 0.00001774 0.40254 12.4611
93 1UF5 CDT 0.008265 0.40679 12.5413
94 2W3L DRO 0.04647 0.40755 13.8889
95 1QJC PNS 0.001612 0.41661 16.4557
96 3BRN SRO 0.008198 0.41187 17.1975
97 2BNE U5P 0.00004212 0.44697 17.8423
98 1O9U ADZ 0.002226 0.47607 27.7778
Pocket No.: 5; Query (leader) PDB : 2QS8; Ligand: MET; 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: 2qs8.bio4) has 14 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 6; Query (leader) PDB : 2QS8; Ligand: MET; Similar sites found: 3
This union binding pocket(no: 6) in the query (biounit: 2qs8.bio4) has 15 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 5HVJ ANP 0.002231 0.44549 2.22222
2 3KA2 2NC 0.03419 0.42017 2.95567
3 5UR1 YY9 0.03451 0.40343 4.18006
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