Receptor
PDB id Resolution Class Description Source Keywords
4qe4 1.7 Å EC: 5.3.1.5 ROOM TEMPERATURE X-RAY STRUCTURE OF D-XYLOSE ISOMERASE IN CO TWO NI2+ IONS AND L-RIBULOSE STREPTOMYCES RUBIGINOSUS TIM BARREL SUGAR ISOMERASE MONOSACCHARIDES ISOMERASE
Ref.: L-ARABINOSE BINDING, ISOMERIZATION, AND EPIMERIZATI D-XYLOSE ISOMERASE: X-RAY/NEUTRON CRYSTALLOGRAPHIC MOLECULAR SIMULATION STUDY. STRUCTURE V. 22 1287 2014
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
NI A:403;
A:401;
 Part of Protein;
Part of Protein;
 none;
none;
 submit data
58.693 Ni [Ni+2...
34V A:404;
 Valid;
 none;
 submit data
150.13 C5 H10 O5 C1[C@...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2GYI 1.6 Å EC: 5.3.1.5 DESIGN, SYNTHESIS, AND CHARACTERIZATION OF A POTENT XYLOSE I INHIBITOR, D-THREONOHYDROXAMIC ACID, AND HIGH-RESOLUTION X-C RYSTALLOGRAPHIC STRUCTURE OF THE ENZYME-INHIBITOR COMPLEX STREPTOMYCES OLIVOCHROMOGENES ISOMERASE(INTRAMOLECULAR OXIDOREDUCTASE)
Ref.: DESIGN, SYNTHESIS, AND CHARACTERIZATION OF A POTENT ISOMERASE INHIBITOR, D-THREONOHYDROXAMIC ACID, AND HIGH-RESOLUTION X-RAY CRYSTALLOGRAPHIC STRUCTURE OF ENZYME-INHIBITOR COMPLEX BIOCHEMISTRY V. 34 3742 1995
Members (39)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 4 families.
1 1S5M - GLC C6 H12 O6 C([C@@H]1[....
2 3KBM - GLC C6 H12 O6 C([C@@H]1[....
3 4QEH - 32O C5 H10 O5 C([C@H]1[C....
4 3U3H - 03W C3 H8 O4 C([C@H](C(....
5 1XID - ASC C6 H8 O6 C([C@@H]([....
6 4DUO - XYL C5 H12 O5 C([C@@H](C....
7 4QE5 - RUU C5 H10 O5 C1[C@@H]([....
8 6RNF - GLC C6 H12 O6 C([C@@H]1[....
9 1XIH - SOR C6 H14 O6 C([C@@H]([....
10 4ZBC - GLC C6 H12 O6 C([C@@H]1[....
11 4QEE - Z6J C5 H10 O5 C([C@H]1[C....
12 1XIG - XYL C5 H12 O5 C([C@@H](C....
13 1XYC - 3MF C7 H14 O6 CO[C@@H]([....
14 5ZYE - GLC C6 H12 O6 C([C@@H]1[....
15 2XIS - XYL C5 H12 O5 C([C@@H](C....
16 1XYM - GLO C6 H12 O6 C([C@H]([C....
17 8XIA - XLS C5 H10 O5 C([C@H]([C....
18 1XIJ - THE C4 H7 O5 C([C@H]([C....
19 4XIS - XLS C5 H10 O5 C([C@H]([C....
20 1GW9 - LXC C5 H10 O5 C1[C@@H]([....
21 1XIC - XLS C5 H10 O5 C([C@H]([C....
22 1XII - XUL C5 H10 O5 C([C@H]([C....
23 6QNI - GLC C6 H12 O6 C([C@@H]1[....
24 4ZB5 - GLC C6 H12 O6 C([C@@H]1[....
25 1XYB - GLO C6 H12 O6 C([C@H]([C....
26 4ZB2 - FRU C6 H12 O6 C([C@@H]1[....
27 6QNJ - GLC C6 H12 O6 C([C@@H]1[....
28 4QE4 - 34V C5 H10 O5 C1[C@@H]([....
29 4ZB0 - GLC C6 H12 O6 C([C@@H]1[....
30 2GYI Ki < 100 nM HYA C4 H9 N O5 C([C@H]([C....
31 4QE1 - RUU C5 H10 O5 C1[C@@H]([....
32 6RND - GLC C6 H12 O6 C([C@@H]1[....
33 1S5N - XYL C5 H12 O5 C([C@@H](C....
34 1XIF - GLC C6 H12 O6 C([C@@H]1[....
35 3XIS - XLS C5 H10 O5 C([C@H]([C....
36 6QND - GLO C6 H12 O6 C([C@H]([C....
37 1XIE - ASO C6 H12 O5 C1[C@@H]([....
38 3KBN - GLO C6 H12 O6 C([C@H]([C....
39 6QNC - GLC C6 H12 O6 C([C@@H]1[....
70% Homology Family (59)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1S5M - GLC C6 H12 O6 C([C@@H]1[....
2 3KBM - GLC C6 H12 O6 C([C@@H]1[....
3 4QEH - 32O C5 H10 O5 C([C@H]1[C....
4 3U3H - 03W C3 H8 O4 C([C@H](C(....
5 1XID - ASC C6 H8 O6 C([C@@H]([....
6 4DUO - XYL C5 H12 O5 C([C@@H](C....
7 4QE5 - RUU C5 H10 O5 C1[C@@H]([....
8 6RNF - GLC C6 H12 O6 C([C@@H]1[....
9 1XIH - SOR C6 H14 O6 C([C@@H]([....
10 4ZBC - GLC C6 H12 O6 C([C@@H]1[....
11 4QEE - Z6J C5 H10 O5 C([C@H]1[C....
12 1XIG - XYL C5 H12 O5 C([C@@H](C....
13 1XYC - 3MF C7 H14 O6 CO[C@@H]([....
14 5ZYE - GLC C6 H12 O6 C([C@@H]1[....
15 2XIS - XYL C5 H12 O5 C([C@@H](C....
16 1XYM - GLO C6 H12 O6 C([C@H]([C....
17 8XIA - XLS C5 H10 O5 C([C@H]([C....
18 1XIJ - THE C4 H7 O5 C([C@H]([C....
19 4XIS - XLS C5 H10 O5 C([C@H]([C....
20 1GW9 - LXC C5 H10 O5 C1[C@@H]([....
21 1XIC - XLS C5 H10 O5 C([C@H]([C....
22 1XII - XUL C5 H10 O5 C([C@H]([C....
23 6QNI - GLC C6 H12 O6 C([C@@H]1[....
24 4ZB5 - GLC C6 H12 O6 C([C@@H]1[....
25 1XYB - GLO C6 H12 O6 C([C@H]([C....
26 4ZB2 - FRU C6 H12 O6 C([C@@H]1[....
27 6QNJ - GLC C6 H12 O6 C([C@@H]1[....
28 4QE4 - 34V C5 H10 O5 C1[C@@H]([....
29 4ZB0 - GLC C6 H12 O6 C([C@@H]1[....
30 2GYI Ki < 100 nM HYA C4 H9 N O5 C([C@H]([C....
31 4QE1 - RUU C5 H10 O5 C1[C@@H]([....
32 6RND - GLC C6 H12 O6 C([C@@H]1[....
33 1S5N - XYL C5 H12 O5 C([C@@H](C....
34 1XIF - GLC C6 H12 O6 C([C@@H]1[....
35 3XIS - XLS C5 H10 O5 C([C@H]([C....
36 6QND - GLO C6 H12 O6 C([C@H]([C....
37 1XIE - ASO C6 H12 O5 C1[C@@H]([....
38 3KBN - GLO C6 H12 O6 C([C@H]([C....
39 6QNC - GLC C6 H12 O6 C([C@@H]1[....
40 1DID - DIG C6 H13 N O4 C([C@H]1[C....
41 1XLC - XYL C5 H12 O5 C([C@@H](C....
42 1XLJ - XYL C5 H12 O5 C([C@@H](C....
43 1DIE - NOJ C6 H13 N O4 C1[C@@H]([....
44 1XLF - GCO C6 H12 O7 C([C@H]([C....
45 4XIA - SOR C6 H14 O6 C([C@@H]([....
46 1XLM - XYL C5 H12 O5 C([C@@H](C....
47 5XIA - XYL C5 H12 O5 C([C@@H](C....
48 1XLI Ki = 33 mM GLT C6 H12 O5 S C([C@@H]1[....
49 1XLG - XYL C5 H12 O5 C([C@@H](C....
50 1XLD - XYL C5 H12 O5 C([C@@H](C....
51 2XIN - SOR C6 H14 O6 C([C@@H]([....
52 8XIM - XLS C5 H10 O5 C([C@H]([C....
53 1XIM - XYL C5 H12 O5 C([C@@H](C....
54 2XIM - XYL C5 H12 O5 C([C@@H](C....
55 1XIN - XYL C5 H12 O5 C([C@@H](C....
56 3XIM - SOR C6 H14 O6 C([C@@H]([....
57 5XIN - XLS C5 H10 O5 C([C@H]([C....
58 9XIM - XLS C5 H10 O5 C([C@H]([C....
59 6XIM - XLS C5 H10 O5 C([C@H]([C....
50% Homology Family (59)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1S5M - GLC C6 H12 O6 C([C@@H]1[....
2 3KBM - GLC C6 H12 O6 C([C@@H]1[....
3 4QEH - 32O C5 H10 O5 C([C@H]1[C....
4 3U3H - 03W C3 H8 O4 C([C@H](C(....
5 1XID - ASC C6 H8 O6 C([C@@H]([....
6 4DUO - XYL C5 H12 O5 C([C@@H](C....
7 4QE5 - RUU C5 H10 O5 C1[C@@H]([....
8 6RNF - GLC C6 H12 O6 C([C@@H]1[....
9 1XIH - SOR C6 H14 O6 C([C@@H]([....
10 4ZBC - GLC C6 H12 O6 C([C@@H]1[....
11 4QEE - Z6J C5 H10 O5 C([C@H]1[C....
12 1XIG - XYL C5 H12 O5 C([C@@H](C....
13 1XYC - 3MF C7 H14 O6 CO[C@@H]([....
14 5ZYE - GLC C6 H12 O6 C([C@@H]1[....
15 2XIS - XYL C5 H12 O5 C([C@@H](C....
16 1XYM - GLO C6 H12 O6 C([C@H]([C....
17 8XIA - XLS C5 H10 O5 C([C@H]([C....
18 1XIJ - THE C4 H7 O5 C([C@H]([C....
19 4XIS - XLS C5 H10 O5 C([C@H]([C....
20 1GW9 - LXC C5 H10 O5 C1[C@@H]([....
21 1XIC - XLS C5 H10 O5 C([C@H]([C....
22 1XII - XUL C5 H10 O5 C([C@H]([C....
23 6QNI - GLC C6 H12 O6 C([C@@H]1[....
24 4ZB5 - GLC C6 H12 O6 C([C@@H]1[....
25 1XYB - GLO C6 H12 O6 C([C@H]([C....
26 4ZB2 - FRU C6 H12 O6 C([C@@H]1[....
27 6QNJ - GLC C6 H12 O6 C([C@@H]1[....
28 4QE4 - 34V C5 H10 O5 C1[C@@H]([....
29 4ZB0 - GLC C6 H12 O6 C([C@@H]1[....
30 2GYI Ki < 100 nM HYA C4 H9 N O5 C([C@H]([C....
31 4QE1 - RUU C5 H10 O5 C1[C@@H]([....
32 6RND - GLC C6 H12 O6 C([C@@H]1[....
33 1S5N - XYL C5 H12 O5 C([C@@H](C....
34 1XIF - GLC C6 H12 O6 C([C@@H]1[....
35 3XIS - XLS C5 H10 O5 C([C@H]([C....
36 6QND - GLO C6 H12 O6 C([C@H]([C....
37 1XIE - ASO C6 H12 O5 C1[C@@H]([....
38 3KBN - GLO C6 H12 O6 C([C@H]([C....
39 6QNC - GLC C6 H12 O6 C([C@@H]1[....
40 1DID - DIG C6 H13 N O4 C([C@H]1[C....
41 1XLC - XYL C5 H12 O5 C([C@@H](C....
42 1XLJ - XYL C5 H12 O5 C([C@@H](C....
43 1DIE - NOJ C6 H13 N O4 C1[C@@H]([....
44 1XLF - GCO C6 H12 O7 C([C@H]([C....
45 4XIA - SOR C6 H14 O6 C([C@@H]([....
46 1XLM - XYL C5 H12 O5 C([C@@H](C....
47 5XIA - XYL C5 H12 O5 C([C@@H](C....
48 1XLI Ki = 33 mM GLT C6 H12 O5 S C([C@@H]1[....
49 1XLG - XYL C5 H12 O5 C([C@@H](C....
50 1XLD - XYL C5 H12 O5 C([C@@H](C....
51 2XIN - SOR C6 H14 O6 C([C@@H]([....
52 8XIM - XLS C5 H10 O5 C([C@H]([C....
53 1XIM - XYL C5 H12 O5 C([C@@H](C....
54 2XIM - XYL C5 H12 O5 C([C@@H](C....
55 1XIN - XYL C5 H12 O5 C([C@@H](C....
56 3XIM - SOR C6 H14 O6 C([C@@H]([....
57 5XIN - XLS C5 H10 O5 C([C@H]([C....
58 9XIM - XLS C5 H10 O5 C([C@H]([C....
59 6XIM - XLS C5 H10 O5 C([C@H]([C....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: 34V; Similar ligands found: 4
No: Ligand ECFP6 Tc MDL keys Tc
1 34V 1 1
2 RUU 1 1
3 SOE 0.625 0.857143
4 BDF 0.625 0.857143
Similar Ligands (3D)
Ligand no: 1; Ligand: 34V; Similar ligands found: 341
No: Ligand Similarity coefficient
1 0MK 0.9517
2 XUL 0.9444
3 ARB 0.9369
4 TLA 0.9358
5 SVJ 0.9349
6 PAV 0.9339
7 PAF 0.9328
8 RIP 0.9318
9 LRH 0.9316
10 EDG 0.9315
11 KPL 0.9310
12 THE 0.9309
13 VAH 0.9299
14 DMV 0.9298
15 AHR 0.9267
16 DFU 0.9266
17 XYS 0.9260
18 AHB 0.9257
19 R2B 0.9241
20 IFL 0.9223
21 Z6J 0.9207
22 SNE 0.9206
23 ABE 0.9206
24 3V4 0.9200
25 PTO 0.9198
26 ROR 0.9197
27 RAM 0.9194
28 AC5 0.9193
29 LDU 0.9193
30 RIB 0.9190
31 4PW 0.9190
32 THR 0.9190
33 BDR 0.9188
34 FCA 0.9187
35 ARW 0.9180
36 FUC 0.9176
37 BGC 0.9170
38 TNE 0.9169
39 CNL 0.9163
40 TMH 0.9148
41 PCA 0.9146
42 FUL 0.9141
43 2AS 0.9140
44 CAM 0.9137
45 CP 0.9134
46 PBE 0.9128
47 KIV 0.9126
48 SEJ 0.9126
49 XXR 0.9125
50 AGK 0.9124
51 XYP 0.9124
52 RSF 0.9122
53 HSE 0.9119
54 DMJ 0.9116
55 UYA 0.9114
56 2MH 0.9113
57 FUF 0.9110
58 FUB 0.9106
59 64K 0.9103
60 ASP 0.9101
61 OHG 0.9099
62 6HQ 0.9098
63 51F 0.9098
64 8EZ 0.9097
65 VAL 0.9096
66 XLS 0.9094
67 HYP 0.9090
68 IFM 0.9087
69 5AC 0.9086
70 URA 0.9083
71 YHO 0.9083
72 GIF 0.9081
73 SYN 0.9081
74 AZF 0.9079
75 PRO 0.9077
76 UY7 0.9075
77 YTB 0.9062
78 LMR 0.9061
79 TFB 0.9061
80 TAR 0.9056
81 32O 0.9056
82 ITN 0.9056
83 ARA 0.9053
84 DUC 0.9050
85 AKB 0.9045
86 BAM 0.9044
87 PAE 0.9041
88 IF7 0.9037
89 NCM 0.9035
90 R1X 0.9033
91 FA1 0.9032
92 GLC 0.9032
93 GLU 0.9031
94 3ZQ 0.9029
95 3OC 0.9028
96 HPY 0.9028
97 IMR 0.9027
98 HDA 0.9017
99 4JU 0.9016
100 MLT 0.9016
101 JZ3 0.9015
102 AKG 0.9015
103 SRT 0.9015
104 IQ0 0.9013
105 4DX 0.9006
106 BMA 0.9005
107 DIG 0.9004
108 3DY 0.8999
109 OAA 0.8998
110 2XX 0.8996
111 CGB 0.8993
112 RBL 0.8989
113 IOM 0.8989
114 23B 0.8986
115 ASN 0.8986
116 H3M 0.8985
117 1LN 0.8981
118 ADO 0.8981
119 5DI 0.8977
120 RB5 0.8971
121 XYL 0.8971
122 RB0 0.8971
123 LEU 0.8971
124 BEN 0.8966
125 QFH 0.8963
126 MAE 0.8963
127 GLL 0.8962
128 192 0.8961
129 H76 0.8958
130 AFR 0.8957
131 APY 0.8955
132 QDK 0.8954
133 1AB 0.8951
134 9X7 0.8951
135 2DR 0.8949
136 GOO 0.8947
137 40O 0.8946
138 GCS 0.8944
139 RP7 0.8943
140 ILE 0.8942
141 9TY 0.8941
142 DGJ 0.8939
143 GXL 0.8938
144 WTZ 0.8934
145 FLA 0.8931
146 HZP 0.8931
147 N7P 0.8927
148 KOJ 0.8922
149 YCP 0.8915
150 FPI 0.8913
151 5HY 0.8911
152 O7U 0.8911
153 HV2 0.8910
154 1DU 0.8909
155 BAE 0.8906
156 MRZ 0.8906
157 FRU 0.8902
158 MNM 0.8901
159 98J 0.8901
160 SAL 0.8901
161 CAH 0.8897
162 G4D 0.8895
163 EHM 0.8894
164 MAN 0.8894
165 DTL 0.8893
166 PYG 0.8888
167 JYD 0.8887
168 PRI 0.8887
169 LCN 0.8886
170 CRN 0.8886
171 5FX 0.8885
172 4CS 0.8884
173 SF6 0.8881
174 280 0.8880
175 AMC 0.8879
176 DAB 0.8877
177 ALO 0.8875
178 MRY 0.8872
179 4XR 0.8870
180 HY3 0.8868
181 B24 0.8868
182 MLI 0.8867
183 DFB 0.8867
184 149 0.8866
185 NXA 0.8865
186 GLA 0.8862
187 PRS 0.8859
188 3SY 0.8857
189 285 0.8856
190 OAF 0.8855
191 3XX 0.8850
192 7N0 0.8848
193 ECE 0.8846
194 7A8 0.8843
195 M6W 0.8842
196 23W 0.8841
197 6LW 0.8839
198 FEH 0.8839
199 NVA 0.8836
200 JZ7 0.8834
201 TZE 0.8834
202 BE2 0.8830
203 RM1 0.8828
204 ES6 0.8820
205 R8A 0.8819
206 IDH 0.8819
207 NEQ 0.8818
208 286 0.8817
209 2TQ 0.8816
210 RNS 0.8813
211 DHS 0.8811
212 GAG 0.8811
213 SER 0.8808
214 CYS 0.8806
215 RHU 0.8804
216 MFU 0.8802
217 278 0.8802
218 PSV 0.8801
219 69O 0.8801
220 FP1 0.8798
221 1XX 0.8798
222 HUI 0.8794
223 ICC 0.8794
224 MFB 0.8794
225 MET 0.8794
226 308 0.8791
227 3U4 0.8790
228 L3Q 0.8787
229 7EX 0.8781
230 QIC 0.8777
231 LXC 0.8775
232 2FT 0.8774
233 ICF 0.8774
234 HCS 0.8773
235 URQ 0.8772
236 284 0.8769
237 MLA 0.8768
238 MEV 0.8767
239 IT2 0.8767
240 CIZ 0.8767
241 FX1 0.8766
242 FPK 0.8766
243 LFR 0.8765
244 GG6 0.8763
245 IP0 0.8762
246 OXZ 0.8759
247 6F0 0.8753
248 GAF 0.8752
249 NOJ 0.8751
250 VNJ 0.8750
251 IT9 0.8749
252 A2Q 0.8746
253 261 0.8743
254 2PC 0.8741
255 JZ5 0.8739
256 JZ1 0.8734
257 DTU 0.8727
258 3SL 0.8726
259 HHA 0.8725
260 3DM 0.8724
261 CHT 0.8723
262 HY1 0.8723
263 ODV 0.8722
264 6KX 0.8720
265 DPR 0.8718
266 DZX 0.8717
267 COI 0.8716
268 95Z 0.8716
269 JZ4 0.8712
270 ASC 0.8710
271 OXQ 0.8706
272 K6H 0.8704
273 X6X 0.8703
274 GBD 0.8702
275 2HE 0.8701
276 2LP 0.8698
277 4XX 0.8689
278 PEA 0.8685
279 TEO 0.8685
280 PGA 0.8685
281 GAL 0.8682
282 B0D 0.8680
283 3SK 0.8675
284 WOO 0.8674
285 TZL 0.8674
286 LER 0.8673
287 2CO 0.8671
288 271 0.8669
289 HIO 0.8669
290 PEL 0.8667
291 CXF 0.8661
292 CXL 0.8659
293 CYH 0.8659
294 SYG 0.8655
295 03W 0.8655
296 260 0.8655
297 CMS 0.8655
298 HIU 0.8654
299 SF9 0.8654
300 MUC 0.8654
301 RNT 0.8648
302 3PY 0.8648
303 CEE 0.8646
304 3MC 0.8644
305 MD0 0.8644
306 1WD 0.8643
307 60P 0.8642
308 8EW 0.8641
309 T2C 0.8640
310 4RW 0.8638
311 3HR 0.8627
312 4VY 0.8626
313 3HL 0.8624
314 FFP 0.8622
315 LNO 0.8618
316 CFI 0.8617
317 2AL 0.8617
318 MED 0.8614
319 XM0 0.8613
320 XBT 0.8612
321 3FA 0.8611
322 MBD 0.8607
323 273 0.8604
324 DGY 0.8604
325 SR1 0.8599
326 KYD 0.8584
327 FLM 0.8584
328 GBN 0.8584
329 4SV 0.8581
330 G2F 0.8580
331 MSN 0.8574
332 6MH 0.8572
333 2C9 0.8570
334 4NG 0.8569
335 GRE 0.8564
336 PZI 0.8564
337 CSS 0.8552
338 DPF 0.8544
339 3MH 0.8542
340 G3P 0.8542
341 2MY 0.8530
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2GYI; Ligand: HYA; Similar sites found with APoc: 6
This union binding pocket(no: 1) in the query (biounit: 2gyi.bio1) has 63 residues
No: Leader PDB Ligand Sequence Similarity
1 1DE6 RNS 7.51295
2 1DE6 RNS 7.51295
3 1DE6 RNS 7.51295
4 1DE6 RNS 7.51295
5 2I56 RNS 10.8808
6 2I56 RNS 10.8808
Pocket No.: 2; Query (leader) PDB : 2GYI; Ligand: HYA; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 2) in the query (biounit: 2gyi.bio1) has 63 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 2GYI; Ligand: HYA; Similar sites found with APoc: 6
This union binding pocket(no: 3) in the query (biounit: 2gyi.bio1) has 63 residues
No: Leader PDB Ligand Sequence Similarity
1 1DE6 RNS 7.51295
2 1DE6 RNS 7.51295
3 1DE6 RNS 7.51295
4 1DE6 RNS 7.51295
5 2I56 RNS 10.8808
6 2I56 RNS 10.8808
Pocket No.: 4; Query (leader) PDB : 2GYI; Ligand: HYA; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 4) in the query (biounit: 2gyi.bio1) has 63 residues
No: Leader PDB Ligand Sequence Similarity
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