Receptor
PDB id Resolution Class Description Source Keywords
3NJQ 2 Å NON-ENZYME: OTHER CRYSTAL STRUCTURE OF KAPOSI'S SARCOMA-ASSOCIATED HERPESVIRUS IN COMPLEX WITH DIMER DISRUPTOR HUMAN HERPESVIRUS 8 TYPE M PROTEIN-DIMER DISRUPTOR COMPLEX KSHV KSHV PROTEASE HERPESPROTEASE VIRAL PROTEIN-INHIBITOR COMPLEX
Ref.: ENZYME INHIBITION BY ALLOSTERIC CAPTURE OF AN INACT CONFORMATION. J.MOL.BIOL. V. 411 999 2011
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ACT A:1;
Invalid;
none;
submit data
59.044 C2 H3 O2 CC(=O...
GOL B:197;
Invalid;
none;
submit data
92.094 C3 H8 O3 C(C(C...
NJQ A:197;
B:198;
B:199;
Valid;
Valid;
Valid;
none;
none;
none;
Kd = 1.7 uM
428.523 C27 H28 N2 O3 c1ccc...
SO4 B:1;
B:2;
B:3;
Invalid;
Invalid;
Invalid;
none;
none;
none;
submit data
96.063 O4 S [O-]S...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3NJQ 2 Å NON-ENZYME: OTHER CRYSTAL STRUCTURE OF KAPOSI'S SARCOMA-ASSOCIATED HERPESVIRUS IN COMPLEX WITH DIMER DISRUPTOR HUMAN HERPESVIRUS 8 TYPE M PROTEIN-DIMER DISRUPTOR COMPLEX KSHV KSHV PROTEASE HERPESPROTEASE VIRAL PROTEIN-INHIBITOR COMPLEX
Ref.: ENZYME INHIBITION BY ALLOSTERIC CAPTURE OF AN INACT CONFORMATION. J.MOL.BIOL. V. 411 999 2011
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1256 families.
1 3NJQ Kd = 1.7 uM NJQ C27 H28 N2 O3 c1ccc(cc1)....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1068 families.
1 3NJQ Kd = 1.7 uM NJQ C27 H28 N2 O3 c1ccc(cc1)....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 922 families.
1 3NJQ Kd = 1.7 uM NJQ C27 H28 N2 O3 c1ccc(cc1)....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: NJQ; Similar ligands found: 5
No: Ligand ECFP6 Tc MDL keys Tc
1 NJQ 1 1
2 24Q 0.772727 0.6
3 25G 0.649485 0.631579
4 8OY 0.641304 0.953488
5 8N4 0.518519 0.773585
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3NJQ; Ligand: NJQ; Similar sites found: 282
This union binding pocket(no: 1) in the query (biounit: 3njq.bio2) has 14 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4DA6 GA2 0.00001879 0.48237 None
2 1SS4 GSH 0.005502 0.47692 None
3 3ZZS TRP 0.00001123 0.46705 None
4 1NU4 MLA 0.0003952 0.46634 None
5 3QDT A2G GAL 0.002917 0.46179 None
6 3QDY A2G GAL 0.004567 0.45214 None
7 3QDY CBS 0.004995 0.4432 None
8 1SS4 CIT 0.01113 0.44119 None
9 3KP6 SAL 0.004008 0.43298 None
10 2HMT NAI 0.0005513 0.42792 None
11 2BNE U5P 0.0004043 0.41673 None
12 2BNF UTP 0.0007897 0.41336 None
13 1UO5 PIH 0.00849 0.41198 None
14 1UO4 PIH 0.009402 0.40742 None
15 3KPE TM3 0.02375 0.40548 None
16 2FR6 CTN 0.003376 0.40167 None
17 1WKL ADP 0.0004316 0.4331 1.45985
18 3OIG NAD 0.00002296 0.48335 1.5544
19 4FR3 0V4 0.00005655 0.47765 1.5544
20 3OIG IMJ 0.00001561 0.45944 1.5544
21 4FR3 LYS ARG ARG LYS SEP VAL 0.0001911 0.45935 1.5544
22 2BGM NAJ 0.0001307 0.45608 1.5544
23 2YYJ FAD 0.001736 0.43166 1.5544
24 2YYJ 4HP 0.001736 0.43166 1.5544
25 2BGM MAX 0.0001158 0.41538 1.5544
26 1A8S PPI 0.006566 0.40866 1.5544
27 1A5Z OXM 0.001242 0.48016 1.5674
28 1A5Z FBP 0.00003515 0.46603 1.5674
29 4F8L GAL 0.007644 0.46596 2.06897
30 1RZM E4P 0.004916 0.44353 2.07254
31 1QCA FUA 0.0008927 0.43338 2.07254
32 2TOH HBI 0.0000337 0.43154 2.07254
33 1I0Z OXM 0.02275 0.42381 2.07254
34 2ET1 GLV 0.000003614 0.41647 2.07254
35 2QCX PF1 0.01081 0.41596 2.07254
36 2Q1A 2KT 0.0007 0.41369 2.07254
37 2HFK E4H 0.01063 0.41131 2.07254
38 1Y2W NAG 0.02204 0.40699 2.11268
39 1V7R CIT 0.03511 0.42067 2.15054
40 1JGS SAL 0.0004844 0.49292 2.17391
41 2C1Q BTN 0.000001877 0.49755 2.38095
42 1LNX URI 0.01325 0.40718 2.46914
43 4B9E FAH 0.004102 0.44728 2.59067
44 4QCK ASD 0.00003164 0.44383 2.59067
45 3MAG 3MA 0.01672 0.43823 2.59067
46 1YBH FAD 0.003633 0.42245 2.59067
47 3LTW HLZ 0.01091 0.42115 2.59067
48 4QN7 G39 0.0003588 0.42035 2.59067
49 1CR1 TTP 0.003937 0.41322 2.59067
50 1SQ5 PAU 0.01236 0.40849 2.59067
51 2XDQ MGX 0.04757 0.40701 2.59067
52 4DNJ ANN 0.01562 0.40364 2.59067
53 2VDJ HSE 0.04869 0.40077 2.59067
54 1ULE GLA GAL NAG 0.03619 0.40729 2.66667
55 3O03 NAP 0.005743 0.40087 2.74914
56 4HGP KDO 0.0005102 0.4156 2.77778
57 1EDO NAP 0.000003562 0.51832 3.10881
58 1Q3Q ANP 0.000009872 0.49375 3.10881
59 2BLE 5GP 0.00004594 0.47317 3.10881
60 3Q3C NAD 0.00004887 0.46653 3.10881
61 4A3R CIT 0.00003896 0.45028 3.10881
62 3RO7 TDR 0.0008711 0.44837 3.10881
63 4TSK NDP 0.0006654 0.43234 3.10881
64 4KQL 1SG 0.0009266 0.43063 3.10881
65 4KS1 2H8 0.0003773 0.42919 3.10881
66 1RM4 NDP 0.001651 0.42062 3.10881
67 3MMR ABH 0.001387 0.42001 3.10881
68 3ER9 3AT 0.01757 0.40462 3.10881
69 1V1A KDG 0.0001595 0.40382 3.10881
70 1V1A ADP 0.0006598 0.40375 3.10881
71 3Q2I HP7 0.006726 0.40133 3.10881
72 3I0O ADP 0.01167 0.40071 3.10881
73 1OD6 PNS 0.001993 0.41229 3.125
74 4EKV BTN 0.0000129 0.46199 3.14465
75 1ZJ6 G3D 0.004971 0.41129 3.20856
76 1WVC CTP 0.00003624 0.49243 3.62694
77 1XX4 BAM 0.0001844 0.49081 3.62694
78 4IVG ANP 0.00003082 0.47107 3.62694
79 1OMZ UD2 0.00004501 0.45891 3.62694
80 2QS8 MET 0.00001922 0.4498 3.62694
81 1G7V PAI 0.00008696 0.44484 3.62694
82 4OYA 1VE 0.001264 0.44403 3.62694
83 3QVL 5HY 0.0004545 0.43351 3.62694
84 2Z5Y HRM 0.00008327 0.41709 3.62694
85 3ZJ0 ACO 0.02 0.41351 3.62694
86 1FS5 TLA 0.0003082 0.41121 3.62694
87 4AP9 1PS 0.0001299 0.40223 3.62694
88 1KW6 BPY 0.006765 0.40125 3.62694
89 2QXX TTP 0.001363 0.40416 3.68421
90 4K30 NLG 0.01152 0.40982 3.75
91 1O6B ADP 0.0003763 0.43029 4.14201
92 1LDM NAD 0.00002223 0.48746 4.14508
93 1GSA ADP 0.00002783 0.47032 4.14508
94 3KDU NKS 0.003937 0.46616 4.14508
95 1YOE RIB 0.000008381 0.46061 4.14508
96 2NZ2 ASP 0.0009487 0.45653 4.14508
97 1GSA GSH 0.0001467 0.44007 4.14508
98 2NZ2 CIR 0.00003077 0.43997 4.14508
99 3UUD EST 0.005894 0.42635 4.14508
100 1T0S BML 0.01656 0.42431 4.14508
101 4MGB XDH 0.008699 0.42206 4.14508
102 1VCO GLN 0.0001369 0.42079 4.14508
103 3NMV PYV 0.008823 0.41972 4.14508
104 2WL9 MBD 0.0003872 0.41447 4.14508
105 1G2N EPH 0.02251 0.40935 4.14508
106 2Z9V PXM 0.01398 0.40618 4.14508
107 2J07 FAD 0.003067 0.40441 4.14508
108 2J07 HDF 0.003067 0.40441 4.14508
109 2F2U M77 0.009795 0.4038 4.14508
110 3EYK EYK 0.03611 0.40134 4.14508
111 4MG9 27K 0.01228 0.40066 4.14508
112 2GJ3 FAD 0.00004627 0.44093 4.16667
113 3K9W ADE 0.001538 0.43945 4.27807
114 3K9W 4PS 0.001538 0.43945 4.27807
115 2BOI MFU 0.01449 0.40549 4.42478
116 1QJC PNS 0.001965 0.41375 4.43038
117 1DXY NAD 0.0000268 0.50109 4.66321
118 2RDT 2RD 0.0000106 0.50024 4.66321
119 1T26 GBD 0.000425 0.45909 4.66321
120 1T26 NAI 0.000425 0.45909 4.66321
121 2IMP NAI 0.0002692 0.45899 4.66321
122 3CL7 HYN 0.000005376 0.45436 4.66321
123 2RDT FMN 0.0001731 0.45019 4.66321
124 2X61 NGA GAL SIA 0.0002633 0.44586 4.66321
125 2IMP LAC 0.002204 0.44401 4.66321
126 2X61 CH 0.0002357 0.43113 4.66321
127 4C0C WVH 0.0004678 0.42723 4.66321
128 2JE7 XMM 0.0001463 0.41993 4.66321
129 4JP3 CIT 0.0003639 0.41744 4.66321
130 3K3G MMU 0.01006 0.41482 4.66321
131 1MVQ MMA 0.0000547 0.41236 4.66321
132 4CCO OGA 0.01175 0.40943 4.66321
133 3TI8 LNV 0.000006944 0.40779 4.66321
134 2WLT ASP 0.0001842 0.40694 4.66321
135 4P6X HCY 0.02187 0.40525 4.66321
136 4JWX 1N4 0.01642 0.40314 4.66321
137 2PN6 GLN 0.008789 0.40232 4.66667
138 1CMC SAM 0.03714 0.402 4.80769
139 2W3L DRO 0.03993 0.41102 4.86111
140 1N6B DMZ 0.0002211 0.42951 4.86258
141 3F81 STT 0.01923 0.42107 4.91803
142 2OFE NAG 0.01463 0.41526 4.92958
143 1VQ2 DDN 0.000001474 0.52572 5.18135
144 3TKA CTN 0.002416 0.49768 5.18135
145 4N02 FNR 0.00001465 0.48388 5.18135
146 1FA2 DOM 0.000003191 0.47319 5.18135
147 4AF0 IMP 0.00002283 0.47314 5.18135
148 2OWZ F6P 0.00002982 0.45954 5.18135
149 1P4C FMN 0.0003006 0.45034 5.18135
150 1H6W SER LEU ASN TYR ILE ILE LYS VAL LYS GLU 0.0003026 0.43792 5.18135
151 1G6O ADP 0.0004363 0.43679 5.18135
152 4AF0 MOA 0.00002868 0.4335 5.18135
153 3V91 UPG 0.0000001035 0.418 5.18135
154 1RRC ADP 0.00006255 0.41496 5.18135
155 2ZO9 MLI 0.00489 0.41377 5.18135
156 2OWZ CIT 0.0000809 0.41159 5.18135
157 1YMT DR9 0.02642 0.41116 5.18135
158 2NVK NAP 0.0142 0.40587 5.18135
159 4IAE 1DX 0.002128 0.41006 5.29101
160 2W8Q SIN 0.005241 0.42516 5.33881
161 1JA9 PYQ 0.000005256 0.46669 5.69948
162 1XMV ADP 0.00009106 0.45658 5.69948
163 3PLN U5P 0.001657 0.44612 5.69948
164 3M0J OAF 0.00005238 0.44012 5.69948
165 4U36 TNR 0.0000287 0.43515 5.69948
166 2IZ1 ATR 0.006208 0.43245 5.69948
167 1JA9 NDP 0.001119 0.4321 5.69948
168 1DB1 VDX 0.01343 0.43174 5.69948
169 1V6A TRE 0.006166 0.42685 5.69948
170 3FSJ D7K 0.002016 0.42326 5.69948
171 3ZPG 5GP 0.02443 0.42219 5.69948
172 1FNZ A2G 0.0004467 0.42004 5.69948
173 1KTC NGA 0.007326 0.4183 5.69948
174 2JFV FLC 0.01292 0.41775 5.69948
175 2A0W DIH 0.0003906 0.41719 5.69948
176 4LTN FMN 0.000943 0.41637 5.69948
177 4LTN NAI 0.001885 0.41046 5.69948
178 4HE2 AMP 0.00009442 0.40634 5.69948
179 1C1L GAL BGC 0.01143 0.42599 5.83942
180 3NOJ PYR 0.0007552 0.46404 5.88235
181 3QP4 HL0 0.00375 0.40766 6.04396
182 1S8F GDP 0.003215 0.41432 6.21469
183 2ZWS PLM 0.003579 0.4846 6.21762
184 4KCF AKM 0.0000189 0.47806 6.21762
185 2P8B NSK 0.0003868 0.46577 6.21762
186 1I9G SAM 0.00005756 0.45779 6.21762
187 1O9U ADZ 0.02331 0.42326 6.21762
188 4CMF PXG 0.001656 0.41408 6.21762
189 1GJW GLC 0.02096 0.41334 6.21762
190 3VGL BGC 0.000214 0.40584 6.21762
191 2PJL 047 0.001374 0.40037 6.21762
192 4JCA CIT 0.008783 0.45337 6.58683
193 1NVU GTP 0.00001878 0.48237 6.62651
194 1BDB NAD 0.000009482 0.50533 6.73575
195 4LCQ URQ 0.00001979 0.44942 6.73575
196 3CXO 1N5 0.00005387 0.43975 6.73575
197 1QO0 BMD 0.005084 0.43645 6.73575
198 1ZFJ IMP 0.003125 0.4288 6.73575
199 3VKX T3 0.00002194 0.42387 6.73575
200 2EB5 OXL 0.01144 0.4202 6.73575
201 1MZV AMP 0.007396 0.40875 6.73575
202 1FM9 570 0.03424 0.40755 6.73575
203 1HDR NAD 0.003743 0.40157 6.73575
204 1FM9 9CR 0.02702 0.40051 6.73575
205 2FWP CIT 0.0002885 0.41762 7.10383
206 2FWP ICR 0.0005059 0.41572 7.10383
207 3VOZ 04A 0.00008516 0.46313 7.25389
208 4MWV BCZ 0.00006618 0.44593 7.25389
209 2Y6P CTP 0.003 0.42463 7.25389
210 4A2B AGS 0.02266 0.40611 7.25389
211 3SVJ 4LI 0.02487 0.40401 7.25389
212 2JGS BTN 0.006343 0.4236 7.69231
213 3BY8 MLT 0.02075 0.41356 7.74648
214 4KCT PYR 0.005127 0.41993 7.77202
215 4E28 9MZ 0.01811 0.41095 7.77202
216 1NME 159 0.00001383 0.40553 8.21918
217 1UGX GAL MGC 0.00004908 0.42484 8.27068
218 4NVP 7CH 0.0000002821 0.5167 8.29016
219 2H6B 3C4 0.00002695 0.47714 8.29016
220 1LTH NAD 0.00007386 0.46059 8.29016
221 3CKZ ZMR 0.00005796 0.45295 8.29016
222 1Z44 NPO 0.0205 0.44164 8.29016
223 3MB5 SAM 0.00001417 0.48218 8.80829
224 1JQ5 NAD 0.0007718 0.4618 8.80829
225 1SR7 MOF 0.02488 0.41618 8.80829
226 4G1V FAD 0.006991 0.41566 8.80829
227 4A8H PUW 0.00005647 0.41561 8.80829
228 4PNI KQQ 0.001132 0.4 8.80829
229 2ZJ5 ADP 0.003677 0.43685 9.32642
230 3K37 BCZ 0.002088 0.42649 9.32642
231 1CKM GTP 0.005952 0.41723 9.32642
232 43CA NPO 0.01241 0.45865 9.40171
233 1EXB NDP 0.00008586 0.47213 9.70874
234 4O4Z N2O 0.01976 0.40919 9.74026
235 1OTH PAO 0.00004098 0.44499 9.84456
236 4MOB ADP 0.0003452 0.44362 9.84456
237 1JQN DCO 0.000003874 0.43591 9.84456
238 2HJ9 AI2 0.008047 0.40117 9.84456
239 1YRX FMN 0.001015 0.42873 9.91736
240 1D1G MTX 0.01008 0.41244 10.119
241 4HZX G39 0.00004575 0.45366 10.3627
242 1ZZ7 S0H 0.002323 0.4398 10.3627
243 2Q8H TF4 0.01639 0.41416 10.3627
244 4LSJ LSJ 0.02664 0.40246 10.3627
245 1BTN I3P 0.0006381 0.53094 10.3774
246 1Y9Q MED 0.02447 0.40488 10.4167
247 2NLI FMN 0.00001734 0.47929 10.8808
248 2NLI LAC 0.00001734 0.47929 10.8808
249 1V5F FAD 0.003968 0.43928 10.8808
250 1V5F TPP 0.003968 0.43928 10.8808
251 4TMK T5A 0.0003095 0.4708 11.399
252 2GN2 C5P 0.0009011 0.42614 11.399
253 3TO7 COA 0.000813 0.41296 11.399
254 3FSY SCA 0.00151 0.40277 11.399
255 1Y0L HAN 0.04461 0.41495 11.5044
256 1J2Z SOG 0.0003888 0.44173 11.9171
257 2E2R 2OH 0.01275 0.43523 11.9171
258 1LRI CLR 0.02115 0.41077 12.2449
259 1Z34 2FD 0.0001553 0.44892 12.9534
260 2ZI8 SDT 0.00005921 0.43515 12.9534
261 1OFH ADP 0.0008551 0.42948 12.9534
262 3SHR CMP 0.009256 0.4048 12.9534
263 3DUR KDO 0.01237 0.41336 13.2231
264 2FOI JPA 0.009595 0.40416 13.3333
265 3QV9 QV7 0.007146 0.42399 13.4715
266 4M5P 23W 0.04141 0.40433 13.4715
267 3SIX GDP 0.008117 0.4029 13.4715
268 2QLX RM4 0.0008562 0.47975 13.8889
269 1X1T NAD 0.00117 0.43276 13.9896
270 3JQ3 ADP 0.003107 0.42401 15.0259
271 2BJK NAD 0.0005032 0.4334 15.544
272 3BEJ MUF 0.02798 0.40291 15.544
273 2V5E SCR 0.001599 0.49326 15.8416
274 1ECM TSA 0.005865 0.41749 16.5138
275 4LBP 1WG 0.0001739 0.42111 17
276 2AEB ABH 0.001141 0.40285 17.0984
277 4Q3R XA2 0.0001106 0.42087 17.6166
278 4Q3S X7A 0.0003853 0.41094 17.6166
279 3I51 45C 0.005866 0.40846 18.1347
280 4GQB 0XU 0.00007254 0.46085 18.6528
281 3UXL CFI 0.000006248 0.40095 18.6528
282 2XD9 XD9 0.0004159 0.47435 20.9581
Pocket No.: 2; Query (leader) PDB : 3NJQ; Ligand: NJQ; 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: 3njq.bio2) has 14 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 3NJQ; Ligand: NJQ; 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: 3njq.bio2) has 9 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 3NJQ; Ligand: NJQ; Similar sites found: 11
This union binding pocket(no: 4) in the query (biounit: 3njq.bio3) has 19 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1F7K UMP 0.001629 0.41007 None
2 3I0O SMI 0.02762 0.40889 3.10881
3 2QF7 COA 0.01272 0.40325 3.62694
4 3CQ5 PMP 0.02535 0.40208 5.69948
5 1N9L FMN 0.004753 0.40898 6.42202
6 1F1V DHY 0.01225 0.41593 7.77202
7 4FUA PGH 0.001595 0.4026 7.77202
8 4RJK PYR 0.03439 0.43981 8.80829
9 1SJW NGV 0.01104 0.4021 11.1111
10 1GU3 BGC BGC BGC BGC BGC 0.0147 0.4169 12.7517
11 2J5S KTA 0.006016 0.40519 19.171
Pocket No.: 5; Query (leader) PDB : 3NJQ; Ligand: NJQ; 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: 3njq.bio3) has 19 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 6; Query (leader) PDB : 3NJQ; Ligand: NJQ; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 6) in the query (biounit: 3njq.bio3) has 15 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 7; Query (leader) PDB : 3NJQ; Ligand: NJQ; Similar sites found: 14
This union binding pocket(no: 7) in the query (biounit: 3njq.bio1) has 19 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 3KFC 61X 0.02033 0.40324 1.03627
2 5DY5 5GR 0.03662 0.4118 2.59067
3 3FUR Z12 0.01978 0.41543 3.10881
4 4V24 GYR 0.007766 0.42197 3.62694
5 4ZOM 4Q3 0.01609 0.41346 3.62694
6 5L7G 6QE 0.008074 0.40974 3.62694
7 5UC9 MYR 0.01687 0.40878 3.62694
8 5APJ 76E 0.01423 0.40699 3.62694
9 5E7V M7E 0.01255 0.40957 4.14508
10 1YOK P6L 0.02663 0.4008 4.66321
11 5U98 1KX 0.02582 0.41771 6.06061
12 4M8E 29V 0.009002 0.40757 6.73575
13 1YRO UDP 0.009634 0.41475 7.31707
14 2A06 SMA 0.02573 0.40049 26.9231
Pocket No.: 8; Query (leader) PDB : 3NJQ; Ligand: NJQ; 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: 3njq.bio1) has 19 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 9; Query (leader) PDB : 3NJQ; Ligand: NJQ; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 9) in the query (biounit: 3njq.bio1) has 13 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
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