Receptor
PDB id Resolution Class Description Source Keywords
1WHT 2 Å EC: 3.4.16.6 STRUCTURE OF THE COMPLEX OF L-BENZYLSUCCINATE WITH WHEAT SER CARBOXYPEPTIDASE II AT 2.0 ANGSTROMS RESOLUTION TRITICUM AESTIVUM SERINE CARBOXYPEPTIDASE
Ref.: STRUCTURE OF THE COMPLEX OF L-BENZYLSUCCINATE WITH SERINE CARBOXYPEPTIDASE II AT 2.0-A RESOLUTION. BIOCHEMISTRY V. 33 11127 1994
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
BZS A:430;
Valid;
none;
Ki = 0.2 mM
208.211 C11 H12 O4 c1ccc...
FUC NAG NDG A:1132;
Part of Protein;
none;
submit data n/a n/a n/a n/a
NAG A:1131;
Part of Protein;
none;
submit data
221.208 C8 H15 N O6 CC(=O...
NAG NAG B:2911;
Part of Protein;
none;
submit data
408.404 n/a O=C(N...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1WHT 2 Å EC: 3.4.16.6 STRUCTURE OF THE COMPLEX OF L-BENZYLSUCCINATE WITH WHEAT SER CARBOXYPEPTIDASE II AT 2.0 ANGSTROMS RESOLUTION TRITICUM AESTIVUM SERINE CARBOXYPEPTIDASE
Ref.: STRUCTURE OF THE COMPLEX OF L-BENZYLSUCCINATE WITH SERINE CARBOXYPEPTIDASE II AT 2.0-A RESOLUTION. BIOCHEMISTRY V. 33 11127 1994
Members (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 1BCR - ARG C6 H15 N4 O2 C(C[C@@H](....
2 1BCS - ARG C6 H15 N4 O2 C(C[C@@H](....
3 1WHT Ki = 0.2 mM BZS C11 H12 O4 c1ccc(cc1)....
70% Homology Family (4)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 1GXS - DKA C10 H20 O2 CCCCCCCCCC....
2 1BCR - ARG C6 H15 N4 O2 C(C[C@@H](....
3 1BCS - ARG C6 H15 N4 O2 C(C[C@@H](....
4 1WHT Ki = 0.2 mM BZS C11 H12 O4 c1ccc(cc1)....
50% Homology Family (4)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 1GXS - DKA C10 H20 O2 CCCCCCCCCC....
2 1BCR - ARG C6 H15 N4 O2 C(C[C@@H](....
3 1BCS - ARG C6 H15 N4 O2 C(C[C@@H](....
4 1WHT Ki = 0.2 mM BZS C11 H12 O4 c1ccc(cc1)....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: BZS; Similar ligands found: 4
No: Ligand ECFP6 Tc MDL keys Tc
1 BZS 1 1
2 HFA 0.512195 0.727273
3 HF2 0.512195 0.727273
4 PAC 0.425 0.684211
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1WHT; Ligand: BZS; Similar sites found: 514
This union binding pocket(no: 1) in the query (biounit: 1wht.bio1) has 13 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1UO5 PIH 0.003528 0.44952 None
2 2OFD NGA 0.002515 0.41439 None
3 1UO4 PIH 0.01424 0.40955 None
4 1JAC AMG 0.0005343 0.47947 1.50376
5 3JQM GTP 0.001295 0.43614 1.91083
6 2B7N NTM 0.00162 0.412 1.95312
7 1Q8O MAN MMA 0.01216 0.40054 1.96078
8 2AR6 NAG MAN 0.02066 0.40004 1.96078
9 3MBG FAD 0.01273 0.41665 2.15827
10 2XI7 XI7 0.00731 0.43318 2.17391
11 3H22 B53 0.00059 0.45905 2.34375
12 1F8F NAD 0.01013 0.44836 2.34375
13 2BLE 5GP 0.02433 0.43191 2.34375
14 3U5S FAD 0.01241 0.41095 2.38095
15 1XE7 GUN 0.001041 0.45507 2.46305
16 2GJ3 FAD 0.003957 0.44636 2.5
17 2BZ1 TAU 0.0001782 0.51637 2.61438
18 3TKA CTN 0.0008162 0.48574 2.61438
19 1SG4 CO8 0.004761 0.45544 2.61438
20 2X61 CH 0.001585 0.47538 2.73438
21 2X61 NGA GAL SIA 0.03358 0.42352 2.73438
22 1CKN GTP 0.005803 0.40848 2.73438
23 3IO3 ADP 0.004314 0.42785 3.125
24 2RHW C0E 0.00008366 0.55034 3.26797
25 4M5P MLA 0.0005514 0.4788 3.26797
26 3GEG NAD 0.008899 0.42662 3.26797
27 4LTN FMN 0.0209 0.42494 3.26797
28 4LTN NAI 0.0243 0.42494 3.26797
29 3ZY6 GFB 0.006727 0.42294 3.26797
30 2YIV YIV 0.006303 0.41099 3.26797
31 4C2G ALA ALA ALA ALA 0.009825 0.41054 3.26797
32 4G9E C4L 0.01811 0.40596 3.26797
33 4M5P 23W 0.008495 0.40519 3.26797
34 2OZE AGS 0.01431 0.40467 3.26797
35 1UWC FER 0.01664 0.40249 3.26797
36 2F7C CCU 0.002533 0.41767 3.43348
37 4F8L GAL 0.0001811 0.51601 3.44828
38 4LNL 2BO 0.00172 0.44122 3.51562
39 4LNL 2BK 0.00172 0.44122 3.51562
40 1R0X ATP 0.0086 0.4336 3.51562
41 4LNL PLG 0.004904 0.41906 3.51562
42 1I9G SAM 0.03471 0.41569 3.51562
43 3TO7 COA 0.02931 0.41332 3.51562
44 1UJ5 5RP 0.001799 0.43552 3.52423
45 3KJI ADP 0.002091 0.4375 3.54331
46 1SBZ FMN 0.006868 0.43702 3.5533
47 3ZLM ANP 0.002607 0.43756 3.7234
48 2FUE M1P 0.003129 0.41048 3.90625
49 1SS4 GSH 0.0002591 0.50841 3.92157
50 4LXH C1E 0.0003707 0.49489 3.92157
51 2V7T SAH 0.004492 0.48321 3.92157
52 1JUV NDP 0.0005842 0.4797 3.92157
53 1SS4 CIT 0.0008781 0.47156 3.92157
54 3R51 MMA 0.00075 0.46173 3.92157
55 1DXY COI 0.0007951 0.46054 3.92157
56 1FDJ 2FP 0.0006505 0.45457 3.92157
57 2YK7 CSF 0.001651 0.4484 3.92157
58 3UR0 SVR 0.007652 0.44718 3.92157
59 1KOL NAD 0.006155 0.44389 3.92157
60 3MAG 3MA 0.002847 0.44389 3.92157
61 2BNE U5P 0.005454 0.44354 3.92157
62 1HQL GLA MBG 0.0007372 0.4276 3.92157
63 4TSK NDP 0.02914 0.42664 3.92157
64 1AX2 NDG GAL 0.000729 0.41664 3.92157
65 2R00 OEG 0.00154 0.41537 3.92157
66 3MCT 3MC 0.0005791 0.41526 3.92157
67 5YAS FAC 0.01187 0.40955 3.92157
68 3NOJ PYR 0.001406 0.40891 3.92157
69 1FDJ 13P 0.005561 0.40345 3.92157
70 2VDJ HSE 0.01081 0.40049 3.92157
71 3A0T ADP 0.01962 0.40599 3.94737
72 4K7O EKZ 0.0007352 0.44415 4.16667
73 1Y9Q MED 0.001509 0.42351 4.16667
74 3SJ0 DXC 0.006332 0.40409 4.22535
75 3DDC GNP 0.000415 0.48481 4.29448
76 4OYA 1VE 0.0192 0.45362 4.29688
77 3VCA PRO 0.0008825 0.41752 4.29688
78 3O03 GCO 0.005416 0.41719 4.29688
79 3O03 NAP 0.01437 0.41561 4.29688
80 1YOE RIB 0.007821 0.40297 4.29688
81 2ALG DAO 0.001589 0.4511 4.34783
82 2ALG HP6 0.001589 0.4511 4.34783
83 3UCJ AZM 0.0009162 0.44251 4.40529
84 2QGI UDP 0.004749 0.4063 4.43548
85 4BAS GNP 0.001801 0.44865 4.52261
86 3PNA CMP 0.0008003 0.40168 4.54545
87 3TLC 7MD 0.0008643 0.47043 4.57516
88 1TIW FAD 0.002215 0.46731 4.57516
89 1TIW TFB 0.002215 0.46731 4.57516
90 1UBY DMA 0.001029 0.45328 4.57516
91 3V1U NAD 0.002086 0.4527 4.57516
92 1NW5 SAM 0.001915 0.44553 4.57516
93 2CSN CKI 0.003323 0.44344 4.57516
94 1Q3Q ANP 0.01523 0.44087 4.57516
95 1NZY BCA 0.004802 0.43903 4.57516
96 9LDT OXM 0.004274 0.43524 4.57516
97 4IZC 1GZ 0.01711 0.43198 4.57516
98 1T26 NAI 0.04635 0.43153 4.57516
99 1T26 GBD 0.04635 0.43153 4.57516
100 2PTZ PAH 0.002879 0.43142 4.57516
101 3MB5 SAM 0.02245 0.42817 4.57516
102 4RNX FMN 0.005056 0.42761 4.57516
103 1V2X SAM 0.006085 0.4231 4.57516
104 3PJU C2E 0.01012 0.42265 4.57516
105 4JUI EGR 0.004864 0.421 4.57516
106 4O8A 2OP 0.007251 0.41568 4.57516
107 2C4I BTN 0.007726 0.41262 4.57516
108 1JXZ BCA 0.02808 0.41048 4.57516
109 2AEB ABH 0.02781 0.40993 4.57516
110 1RYD GLC 0.00363 0.40783 4.57516
111 1NJJ ORX 0.02377 0.4035 4.57516
112 4QXB OGA 0.01403 0.40007 4.57516
113 1ZGA SAH 0.002063 0.43542 4.6875
114 1FP1 HCC 0.004384 0.42754 4.6875
115 2PX6 DH9 0.008783 0.42059 4.6875
116 1I0Z OXM 0.006217 0.41881 4.6875
117 1OMZ UD2 0.03586 0.41339 4.6875
118 2DUA OXL 0.01514 0.40536 4.6875
119 4OK9 HIS 0.001226 0.45211 4.69799
120 5FIT AP2 0.004932 0.41661 4.7619
121 2HMT NAI 0.04269 0.41273 4.86111
122 2HW1 ANP 0.00004649 0.51989 5.07812
123 4PLG NAI 0.001457 0.47489 5.07812
124 4PLG OXM 0.001457 0.47489 5.07812
125 3AHC TPP 0.001311 0.46806 5.07812
126 1ZUW DGL 0.0004176 0.45697 5.07812
127 2HW1 FRU 0.0009122 0.43612 5.07812
128 3I7S PYR 0.0002846 0.43339 5.07812
129 2PLK P3D 0.01314 0.41845 5.07812
130 2WM1 13P 0.00366 0.41411 5.07812
131 3GD4 FAD 0.03909 0.41361 5.07812
132 1D3V ABH 0.0151 0.41322 5.07812
133 4M2K PLP 0.005521 0.4094 5.07812
134 3ZEI AWH 0.03529 0.40613 5.07812
135 1QS0 TDP 0.01567 0.40469 5.07812
136 1OTH PAO 0.02578 0.40076 5.07812
137 1NU4 MLA 0.0008229 0.48213 5.15464
138 3DCM SAM 0.0001032 0.5021 5.20833
139 2I4O ATP 0.0002802 0.46743 5.22876
140 1OAA OAA 0.00385 0.46081 5.22876
141 3ZGE ASP 0.0008828 0.44914 5.22876
142 2WKW W22 0.002462 0.44792 5.22876
143 1E7S NAP 0.004742 0.44459 5.22876
144 3E4O SIN 0.0007415 0.43986 5.22876
145 4FBL SPD 0.002919 0.43809 5.22876
146 2H7C COA 0.02557 0.43716 5.22876
147 4LWA Q13 0.01112 0.43465 5.22876
148 1OFH ADP 0.005485 0.43345 5.22876
149 4A3X LAT 0.0001184 0.43275 5.22876
150 1Y13 BIO 0.002265 0.42861 5.22876
151 1II5 GLU 0.00151 0.42702 5.22876
152 1NF8 BOG 0.001885 0.42664 5.22876
153 2IZ1 ATR 0.00195 0.41893 5.22876
154 1V1A ADP 0.01753 0.41422 5.22876
155 3PY5 AMP 0.007344 0.41358 5.22876
156 2WE5 ADP 0.007353 0.4114 5.22876
157 4KSY 1SY 0.005921 0.40811 5.22876
158 2B4G FMN 0.0295 0.40576 5.22876
159 3VEH 0GA 0.01627 0.40569 5.22876
160 2VAT COA 0.0221 0.40554 5.22876
161 3JDW ORN 0.02164 0.40172 5.22876
162 1PR9 NAP 0.00385 0.45009 5.32787
163 3D3W NAP 0.005621 0.43987 5.32787
164 3B1F NAD 0.002653 0.4429 5.46875
165 3K56 IS3 0.00238 0.43273 5.46875
166 3OIG NAD 0.0332 0.42504 5.46875
167 1CL2 PPG 0.008551 0.41649 5.46875
168 4NMC FAD 0.04711 0.40836 5.46875
169 1YWQ FMN 0.01084 0.40616 5.5
170 3ACC 5GP 0.0002894 0.46373 5.52486
171 1Y2W NAG 0.004087 0.4057 5.6338
172 2WCV FUC 0.007086 0.40479 5.71429
173 1TDF FAD 0.00917 0.44505 5.85938
174 1TDF NAP 0.0176 0.44505 5.85938
175 1P4C FMN 0.0408 0.40503 5.85938
176 1D09 PAL 0.002157 0.50664 5.88235
177 2C7G FAD 0.001124 0.49679 5.88235
178 2C7G ODP 0.001082 0.49679 5.88235
179 2YC5 6BC 0.0008444 0.48375 5.88235
180 3U4C NDP 0.001225 0.46797 5.88235
181 2GSD NAD 0.004643 0.4486 5.88235
182 2OYS FMN 0.001934 0.44726 5.88235
183 2Q3M MLA 0.001925 0.44261 5.88235
184 2X2T GAL NGA 0.001925 0.44261 5.88235
185 4O1M NAD 0.005808 0.43791 5.88235
186 3FED BIX 0.002748 0.43448 5.88235
187 4JLV ADP 0.00791 0.4266 5.88235
188 4M51 BEZ 0.003123 0.42463 5.88235
189 1R18 SAH 0.007419 0.42272 5.88235
190 4N02 FNR 0.03573 0.41948 5.88235
191 2AMV BIN 0.04376 0.41364 5.88235
192 2J7T 274 0.02682 0.40556 5.88235
193 1PL6 572 0.03557 0.40429 5.88235
194 1Q11 TYE 0.001327 0.40397 5.88235
195 3OZG SSI 0.0005533 0.46277 6
196 3QQA TCH 0.01277 0.41204 6.01852
197 2RHO GDP 0.01386 0.41234 6.15385
198 4KCF AKM 0.0004887 0.47796 6.25
199 2PT9 2MH 0.001848 0.46638 6.25
200 2PT9 S4M 0.002507 0.44904 6.25
201 3UH0 TSB 0.002492 0.44588 6.25
202 4KCF FMN 0.001374 0.44549 6.25
203 4BT5 23B 0.001161 0.43814 6.25
204 2Z9V PXM 0.0004759 0.42208 6.25
205 4I42 1HA 0.02251 0.41695 6.25
206 1PEA ACM 0.004802 0.41628 6.25
207 1YOA FMN 0.001401 0.47022 6.28931
208 3QDW A2G 0.002026 0.44157 6.29371
209 3QDT A2G GAL 0.006116 0.41158 6.29371
210 3QDY A2G GAL 0.009473 0.40307 6.29371
211 4B9E FAH 0.001354 0.43279 6.31229
212 1ECM TSA 0.0007983 0.40273 6.42202
213 3P8N L4T 0.02369 0.40259 6.45161
214 2DKH 3HB 0.001597 0.47523 6.53595
215 3GE7 AFQ 0.001303 0.47228 6.53595
216 1GVF PGH 0.0001878 0.4683 6.53595
217 1BGQ RDC 0.00131 0.46357 6.53595
218 3H86 AP5 0.003947 0.46258 6.53595
219 2C31 TZD 0.009324 0.45981 6.53595
220 3CQD ATP 0.003138 0.45896 6.53595
221 2C31 ADP 0.01472 0.44905 6.53595
222 4WBD CIT 0.001248 0.44244 6.53595
223 3E5P PPI 0.01482 0.43841 6.53595
224 2DKH FAD 0.008145 0.43472 6.53595
225 1NN5 ANP 0.007482 0.43278 6.53595
226 1NN5 2DT 0.007482 0.43278 6.53595
227 1QF5 GDP 0.01797 0.43144 6.53595
228 1QF5 RPL 0.01797 0.43144 6.53595
229 4KQI RBZ 0.008669 0.43104 6.53595
230 4KQI NIO 0.008669 0.43104 6.53595
231 1A8R GTP 0.005198 0.42616 6.53595
232 3CXO 1N5 0.01362 0.42181 6.53595
233 3A76 SPD 0.004492 0.42118 6.53595
234 4LFL TG6 0.004016 0.41795 6.53595
235 3CXO 3LR 0.02114 0.4104 6.53595
236 3BS8 PMP 0.007362 0.40909 6.53595
237 2P69 PLP 0.001987 0.40794 6.53595
238 4W6Z ETF 0.01212 0.40523 6.53595
239 1RQH PYR 0.00356 0.40206 6.53595
240 4F4S EFO 0.0005219 0.41651 6.57895
241 1BTN I3P 0.01484 0.42272 6.60377
242 2HVK TBA 0.001748 0.42088 6.60377
243 1F7L COA 0.00582 0.44221 6.61157
244 1QO0 BMD 0.001631 0.42212 6.63265
245 4USQ FAD 0.0003925 0.4982 6.64062
246 2EB5 OXL 0.002034 0.41818 6.64062
247 4HZX G39 0.03076 0.41322 6.64062
248 3Q3C NAD 0.04672 0.41359 6.68896
249 4Q4K FMN 0.007911 0.44163 6.72269
250 1MZV AMP 0.0001108 0.41832 6.80851
251 3GM5 CIT 0.005063 0.40187 6.91824
252 1QJC PNS 0.04917 0.4128 6.96203
253 1F74 NAY 0.0005214 0.4639 7.03125
254 1NVU GTP 0.007446 0.45504 7.03125
255 3UDG TMP 0.0003038 0.42267 7.03125
256 3U1T MLI 0.006278 0.40425 7.03125
257 2HVW DCP 0.003965 0.42308 7.06522
258 2HVW DDN 0.006361 0.41414 7.06522
259 1UQX MMA 0.005426 0.43213 7.07965
260 1TU3 GNP 0.0002323 0.49635 7.18954
261 1L1Q 9DA 0.0001587 0.49377 7.18954
262 1QB7 ADE 0.0001052 0.48562 7.18954
263 2J8Z NAP 0.0006431 0.48096 7.18954
264 1UXG FUM 0.002236 0.46711 7.18954
265 1UXG NAD 0.002236 0.46711 7.18954
266 1P9P SAH 0.002874 0.44134 7.18954
267 2VJJ RAM GLC GAL NAG NAG GLC 0.0128 0.43991 7.18954
268 1LCP PLU 0.005246 0.43434 7.18954
269 3OJI PYV 0.01249 0.42213 7.18954
270 2W8Q SIN 0.00262 0.42052 7.18954
271 1X54 4AD 0.01258 0.41542 7.18954
272 1QM5 GLC GLC GLC PO4 SGC GLC 0.03529 0.41196 7.18954
273 4D1J DGJ 0.006875 0.40923 7.18954
274 2NW9 FT6 0.004675 0.40659 7.18954
275 3IOI 1GW 0.03302 0.40475 7.18954
276 1QDS PGA 0.0003995 0.4029 7.18954
277 1ZED PNP 0.007056 0.40207 7.18954
278 3SUD SUE 0.02641 0.40167 7.18954
279 1UF5 CDT 0.0002864 0.40127 7.18954
280 1B9I PXG 0.0245 0.40067 7.18954
281 2VOT NHV 0.02049 0.40007 7.18954
282 3CBG SAH 0.002737 0.43455 7.32759
283 3CBG 4FE 0.0002094 0.40536 7.32759
284 1V2G OCA 0.005899 0.41325 7.36842
285 2QLX RM4 0.002031 0.42526 7.40741
286 1XRO LEU 0.000002844 0.6393 7.42188
287 3RKR NAP 0.0004253 0.46253 7.42188
288 2NZU BG6 0.0003815 0.45537 7.42188
289 3C1O NAP 0.003196 0.44262 7.42188
290 3DDN HPV 0.004473 0.40739 7.42188
291 3EM1 TYD 0.0003284 0.48674 7.53425
292 4INB 1F6 0.001642 0.44851 7.53425
293 1ZS6 ADP 0.000629 0.40155 7.69231
294 3TXO 07U 0.0004985 0.46223 7.8125
295 2EFJ SAH 0.001321 0.4485 7.8125
296 1GPM CIT 0.002836 0.43 7.8125
297 2XVE FAD 0.03502 0.42508 7.8125
298 1R37 NAD 0.0009667 0.47969 7.84314
299 2HGZ PBF 0.0006351 0.47461 7.84314
300 2DTX BMA 0.00254 0.46554 7.84314
301 1PFK FBP 0.0003184 0.46505 7.84314
302 1I2B NAD 0.007212 0.45573 7.84314
303 1I2B UPG 0.007212 0.45573 7.84314
304 1I2B USQ 0.007212 0.45573 7.84314
305 4EKV BTN 0.003151 0.4542 7.84314
306 1O0D 163 0.001156 0.45106 7.84314
307 2PWY SAH 0.002104 0.44921 7.84314
308 4IVG ANP 0.008675 0.44868 7.84314
309 1YAG ATP 0.002477 0.446 7.84314
310 1T57 FMN 0.003327 0.43846 7.84314
311 1ZFJ IMP 0.03763 0.43721 7.84314
312 3IB8 AMP 0.001879 0.43718 7.84314
313 1DMR PGD 0.04037 0.43348 7.84314
314 2H6B 3C4 0.02464 0.42899 7.84314
315 1C4U IH1 0.004697 0.42718 7.84314
316 1SC3 MLI 0.005423 0.41392 7.84314
317 3A2Q ACA ACA 0.01475 0.41308 7.84314
318 4G1V FAD 0.02812 0.40335 7.84314
319 3R35 4CO 0.005763 0.43936 7.94702
320 1PTR PRB 0.005833 0.40562 8
321 3FS8 ACO 0.04772 0.42459 8.20312
322 3VC3 C6P 0.03784 0.40283 8.20312
323 1B74 DGN 0.009723 0.40256 8.26772
324 3TA2 AKG 0.008029 0.43004 8.47458
325 3TA2 ATP 0.03236 0.40678 8.47458
326 1GAD NAD 0.001129 0.46654 8.49673
327 1JN2 SFP 0.002204 0.46286 8.49673
328 1XVV CCQ 0.003671 0.45785 8.49673
329 2JE7 XMM 0.002154 0.45362 8.49673
330 4DQ2 BTX 0.002741 0.45174 8.49673
331 2FWP ICR 0.005941 0.44351 8.49673
332 1JIL 485 0.00423 0.43016 8.49673
333 2FWP CIT 0.0302 0.40548 8.49673
334 4R84 CSF 0.01734 0.40481 8.49673
335 4U36 TNR 0.02294 0.40343 8.49673
336 4IS0 GDS 0.01563 0.40111 8.49673
337 1VKF CIT 0.01074 0.40366 8.51064
338 2Q97 ATP 0.004418 0.4329 8.52713
339 2PYU IMP 0.00006715 0.48322 8.6758
340 1TUV VK3 0.00816 0.41328 8.77193
341 2J0W ADP 0.006634 0.41758 8.90869
342 2V5E SCR 0.005617 0.42941 8.91089
343 1HFA PIO 0.0009333 0.49461 8.98438
344 2QDT I38 0.005609 0.41872 8.98438
345 1V35 NAI 0.009435 0.44001 9.11854
346 1XOC VAL ASP SER LYS ASN THR SER SER TRP 0.002018 0.47141 9.15033
347 3DAG FEG 0.00101 0.46713 9.15033
348 2YGN PCF 0.001887 0.45926 9.15033
349 2FMD MAN MAN 0.001141 0.45556 9.15033
350 4PO2 ASN ARG LEU LEU LEU THR GLY 0.001393 0.45554 9.15033
351 1WUR 8DG 0.001556 0.45336 9.15033
352 3W2W ATP 0.000697 0.45328 9.15033
353 3Q9T FAY 0.00591 0.44686 9.15033
354 4C0C WVH 0.008569 0.44478 9.15033
355 1HEX NAD 0.003703 0.44426 9.15033
356 1E4X VAL VAL SER HIS PHE ASN ASP 0.001684 0.43926 9.15033
357 1FIQ MTE 0.006041 0.43711 9.15033
358 1FIQ SAL 0.006837 0.43711 9.15033
359 1FIQ FAD 0.0107 0.43025 9.15033
360 1KC7 PPR 0.001807 0.42743 9.15033
361 2DWU DGL 0.0003318 0.41788 9.15033
362 2V3B FAD 0.03457 0.41415 9.15033
363 4MWV BCZ 0.02842 0.41302 9.15033
364 1VR0 3SL 0.00165 0.43167 9.31174
365 1ULE GLA GAL NAG 0.001059 0.44561 9.33333
366 4C0X AQN 0.003962 0.44699 9.35961
367 4C0X FMN 0.003002 0.44699 9.35961
368 3ZS7 ATP 0.006867 0.42424 9.375
369 3WO0 ADP 0.0212 0.41818 9.375
370 3WO0 ALA 0.0212 0.41818 9.375
371 1PJS SAH 0.01885 0.41281 9.375
372 3JQ3 ADP 0.0004162 0.40337 9.375
373 2F01 BTN 0.002105 0.48904 9.44882
374 2F01 BTQ 0.005112 0.46949 9.44882
375 1JA9 NDP 0.005774 0.4687 9.48905
376 4CFS HQD 0.0003881 0.42178 9.7561
377 4BI7 PGA 0.005798 0.4085 9.76562
378 1LTH NAD 0.008366 0.45535 9.80392
379 4F2Q QUS 0.0007483 0.45457 9.80392
380 2CKM AA7 0.009808 0.44644 9.80392
381 1DSS NAD 0.003916 0.44016 9.80392
382 1B8U NAD 0.004603 0.43035 9.80392
383 1B8U OAA 0.01107 0.42725 9.80392
384 1GJW GLC 0.001939 0.42612 9.80392
385 3BL6 FMC 0.005292 0.42391 9.80392
386 3LIH RAF 0.005816 0.42209 9.80392
387 2QIA U20 0.03315 0.42147 9.80392
388 4B9Q ATP 0.03016 0.40318 9.80392
389 4LSJ LSJ 0.00491 0.42908 10.1562
390 1QD0 RR6 0.00005304 0.42013 10.1562
391 1TRD PGH 0.0002794 0.4704 10.4575
392 3HY3 10F 0.002133 0.44894 10.4575
393 2GDZ NAD 0.004048 0.44523 10.4575
394 1G8S MET 0.0006427 0.43875 10.4575
395 1KHT AMP 0.001957 0.42852 10.4575
396 2HXT EHM 0.004376 0.42122 10.4575
397 1H16 DTL 0.0082 0.41318 10.4575
398 4RJK PYR 0.02008 0.41042 10.4575
399 1ZZ7 S0H 0.0006678 0.41234 10.6061
400 3SCH TB6 0.00488 0.40253 10.6061
401 2VAR AMP 0.0002678 0.4121 10.9375
402 1DL7 NCH 0.006225 0.43679 11.0092
403 2HU5 GLY PHE 0.001042 0.4709 11.1111
404 1GSA ADP 0.01744 0.43208 11.1111
405 1RYI GOA 0.01488 0.42498 11.1111
406 1GSA GSH 0.02277 0.42139 11.1111
407 4ARF IP8 GLY PRO ALA 0.006608 0.4156 11.1111
408 2VWT PYR 0.003385 0.4025 11.1111
409 2IMP NAI 0.004134 0.48084 11.3281
410 2HGS GSH 0.0008769 0.45157 11.3281
411 2QQF A1R 0.002324 0.45055 11.3281
412 2HGS ADP 0.006062 0.42669 11.3281
413 1SSQ CYS 0.0305 0.41888 11.3281
414 4CMF PXG 0.03819 0.41661 11.3281
415 1B5E DCM 0.0009028 0.40317 11.3821
416 1A5V Y3 0.0009666 0.42073 11.3924
417 3UEC ALA ARG TPO LYS 0.001952 0.426 11.6438
418 1WVG APR 0.00006447 0.52183 11.7647
419 1C0I FAD 0.001305 0.48563 11.7647
420 1C0I BE2 0.001305 0.48563 11.7647
421 1O9U ADZ 0.0006155 0.46573 11.7647
422 4GQB 0XU 0.006736 0.4557 11.7647
423 1R89 CTP 0.00147 0.4442 11.7647
424 1A69 FMB 0.02553 0.4321 11.7647
425 2P1M IHP 0.008295 0.4252 11.7647
426 2XDQ MGX 0.007924 0.41388 11.7647
427 1WVG CXY 0.01416 0.41 11.7647
428 3RYC GDP 0.02715 0.40683 11.7647
429 4GYW UDP 0.0036 0.45022 12.1094
430 1XX4 BAM 0.01251 0.40458 12.1094
431 1UZN NAP 0.008066 0.4118 12.1457
432 2ZWS PLM 0.003196 0.45174 12.4183
433 1KBJ FMN 0.003452 0.44267 12.4183
434 1RY2 AMP 0.021 0.40661 12.4183
435 2NVK FAD 0.02098 0.4307 12.5
436 1UWZ THU 0.004344 0.42359 12.5
437 1T3D CYS 0.000724 0.44444 12.8906
438 1RQ2 CIT 0.02653 0.4001 12.8906
439 2Z48 A2G 0.0005765 0.45755 13.0719
440 1XHL NDP 0.002616 0.45673 13.0719
441 3FPZ AHZ 0.01326 0.45463 13.0719
442 4TMK T5A 0.0231 0.45289 13.0719
443 3UIE ADX 0.0009904 0.44927 13.0719
444 2Z48 NGA 0.003234 0.40773 13.0719
445 2Z49 AMG 0.002219 0.40704 13.0719
446 3UIE ANP 0.007883 0.40539 13.0719
447 1LLF F23 0.01391 0.43846 13.2812
448 1H9G COA MYR 0.003596 0.44338 13.5802
449 1H8G CHT 0.01581 0.41582 13.6842
450 3KJQ B94 0.0001338 0.4109 13.6842
451 2PNZ UDP 0.001183 0.46399 13.7255
452 2F5T MAL 0.0008463 0.45924 13.7255
453 4R33 SAH 0.004465 0.44705 13.7255
454 4R33 TRP 0.004465 0.44705 13.7255
455 1VJT NAD 0.00428 0.42993 13.7255
456 3VPD ANP 0.005524 0.42679 13.7255
457 3BLI ACO 0.008074 0.42106 13.7255
458 3VPD CIT 0.0001112 0.42037 13.7255
459 3BLI PYR 0.001114 0.41797 13.7255
460 3P3N AKG 0.002125 0.41739 13.7255
461 2XUM OGA 0.002455 0.41482 13.7255
462 4B7E OGA 0.002567 0.40419 13.7255
463 2Y0I AKG 0.002699 0.40289 13.7255
464 1JGS SAL 0.01511 0.41684 13.7681
465 1IYE PGU 0.002012 0.46076 14.3791
466 2OI2 DP6 0.0007869 0.45101 14.3791
467 4NES UDP 0.003517 0.42975 14.3791
468 2YBQ UP2 0.005184 0.44745 14.4531
469 3HQJ COA 0.01091 0.40994 14.6154
470 2YVF NAD 0.005213 0.46707 15.0327
471 2YVF FAD 0.005052 0.46707 15.0327
472 4AIG FLX 0.00423 0.41699 15.0327
473 3SSO SAH 0.01914 0.40245 15.0327
474 4NTD FAD 0.004939 0.45061 15.2344
475 3S9K CIT 0.00372 0.45042 15.2542
476 3GWT 066 0.007139 0.435 15.6863
477 1T0S BML 0.001963 0.43364 16.2791
478 2O66 FLC 0.00272 0.40328 16.2963
479 1Z42 HBA 0.005447 0.44254 16.3399
480 1T8U UAP SGN IDS SGN 0.008516 0.43924 16.3399
481 1T8U A3P 0.006113 0.42301 16.3399
482 1Z44 NPO 0.0126 0.42094 16.3399
483 3N5O GSH 0.008522 0.41471 16.3399
484 4IOK ADP 0.0004852 0.48341 16.9935
485 4IOK XPO 0.001003 0.4638 16.9935
486 3RFV NAI 0.004258 0.44145 16.9935
487 3RFV 15L 0.01658 0.41273 16.9935
488 3ZTV ADN 0.006969 0.41241 16.9935
489 1U7Z PMT 0.003252 0.45355 18.3007
490 3S2Y FMN 0.002316 0.43555 18.3007
491 3SVL FMN 0.003201 0.43155 18.3007
492 1R27 MGD 0.005489 0.44626 18.75
493 3ZRR PXG 0.007206 0.41981 18.75
494 2WQP WQP 0.002122 0.45393 18.9542
495 4EXO PYR 0.01098 0.40018 19.1781
496 1H2K OGA 0.002549 0.41414 19.5122
497 2B82 ADN 0.0005776 0.47081 19.6078
498 2JFV FLC 0.0004178 0.44644 19.6078
499 2XK9 XK9 0.0009099 0.48093 20.2614
500 2BGM NAJ 0.005962 0.46133 20.3125
501 2BGM MAX 0.02664 0.40044 20.3125
502 1WM1 PTB 0.0002867 0.49921 20.915
503 3PNL ADP 0.002939 0.4409 20.915
504 1RZM E4P 0.006897 0.4025 20.915
505 4I71 AGV 0.001953 0.44314 21.5686
506 3F81 STT 0.0002632 0.48296 21.8579
507 1VDC FAD 0.006482 0.4533 22.2222
508 4BMO FMN 0.00191 0.45445 23.0469
509 3Q60 ATP 0.01766 0.40377 24.183
510 1SOW NAD 0.001724 0.46525 25.4902
511 1Y42 TYR 0.001367 0.40168 27.451
512 1H2M OGA 0.002446 0.41488 30.7692
513 2WOR 2AN 0.003072 0.41081 34
514 1TUF AZ1 0.0005832 0.4763 38.5621
Pocket No.: 2; Query (leader) PDB : 1WHT; Ligand: BZS; Similar sites found: 12
This union binding pocket(no: 2) in the query (biounit: 1wht.bio2) has 13 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 3KEE 30B 0.02019 0.40781 6.31579
2 5FJN BE2 0.03899 0.41454 6.53595
3 5FJN FAD 0.03549 0.41454 6.53595
4 4ZZE GLC GLC GLC 0.003895 0.4324 7.8125
5 5F7R GLC GLC 0.008985 0.42327 9.76562
6 4X7G NAP 0.01201 0.41906 9.80392
7 2O4N TPV 0.01953 0.41758 10.101
8 5AOA PPI 0.001569 0.44732 13.0719
9 5JIB OIA 0.00277 0.41912 13.0719
10 2VSU ACO 0.02045 0.40155 13.7255
11 5KY3 GFB 0.02188 0.4075 14.4531
12 5K2M ADP 0.02253 0.4115 18.3007
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