Receptor
PDB id Resolution Class Description Source Keywords
3SJ0 2 Å NON-ENZYME: OTHER PPCA MUTANT M58S GEOBACTER SULFURREDUCENS THREE HEME CYTOCHROME C7 ELECTRON TRANSPORT
Ref.: PITFALLS IN THE INTERPRETATION OF STRUCTURAL CHANGE MUTANT PROTEINS FROM CRYSTAL STRUCTURES. J.STRUCT.FUNCT.GENOM. V. 13 227 2012
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
DXC X:75;
Valid;
none;
submit data
392.572 C24 H40 O4 C[C@H...
HEM X:72;
X:73;
X:74;
Part of Protein;
Part of Protein;
Part of Protein;
none;
none;
none;
submit data
616.487 C34 H32 Fe N4 O4 Cc1c2...
SO4 X:76;
X:77;
X:78;
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
3SJ0 2 Å NON-ENZYME: OTHER PPCA MUTANT M58S GEOBACTER SULFURREDUCENS THREE HEME CYTOCHROME C7 ELECTRON TRANSPORT
Ref.: PITFALLS IN THE INTERPRETATION OF STRUCTURAL CHANGE MUTANT PROTEINS FROM CRYSTAL STRUCTURES. J.STRUCT.FUNCT.GENOM. V. 13 227 2012
Members (4)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1256 families.
1 3SJ0 - DXC C24 H40 O4 C[C@H](CCC....
2 3SEL - DXC C24 H40 O4 C[C@H](CCC....
3 3SJ1 - DXC C24 H40 O4 C[C@H](CCC....
4 3SJ4 - DXC C24 H40 O4 C[C@H](CCC....
70% Homology Family (4)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1068 families.
1 3SJ0 - DXC C24 H40 O4 C[C@H](CCC....
2 3SEL - DXC C24 H40 O4 C[C@H](CCC....
3 3SJ1 - DXC C24 H40 O4 C[C@H](CCC....
4 3SJ4 - DXC C24 H40 O4 C[C@H](CCC....
50% Homology Family (4)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 922 families.
1 3SJ0 - DXC C24 H40 O4 C[C@H](CCC....
2 3SEL - DXC C24 H40 O4 C[C@H](CCC....
3 3SJ1 - DXC C24 H40 O4 C[C@H](CCC....
4 3SJ4 - DXC C24 H40 O4 C[C@H](CCC....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: DXC; Similar ligands found: 11
No: Ligand ECFP6 Tc MDL keys Tc
1 DXC 1 1
2 4OA 0.619048 0.972222
3 CHD 0.609195 1
4 GCH 0.485149 0.714286
5 JN3 0.478261 1
6 82R 0.425743 0.767442
7 LOA 0.424242 0.868421
8 LHP 0.415842 0.846154
9 3KL 0.408163 0.891892
10 AOM 0.404762 0.857143
11 AON 0.404762 0.857143
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3SJ0; Ligand: DXC; Similar sites found: 555
This union binding pocket(no: 1) in the query (biounit: 3sj0.bio2) has 11 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1BTN I3P 0.0001008 0.53149 None
2 1NVU GTP 0.001562 0.4961 None
3 2F59 INI 0.0002321 0.49279 None
4 1UO5 PIH 0.0005216 0.48828 None
5 1T8U UAP SGN IDS SGN 0.001798 0.47879 None
6 1V2X SAM 0.0008077 0.46998 None
7 1T8U A3P 0.0009173 0.46742 None
8 1TU3 GNP 0.001446 0.46729 None
9 4CS4 AXZ 0.004321 0.46487 None
10 1NZY BCA 0.002417 0.45975 None
11 4AF0 IMP 0.006996 0.45782 None
12 4TMK T5A 0.003483 0.45755 None
13 3H86 AP5 0.008581 0.45684 None
14 1P9P SAH 0.002007 0.45544 None
15 2JBZ COA 0.007428 0.45522 None
16 2HV8 GTP 0.002403 0.4552 None
17 2F01 BTQ 0.01302 0.45454 None
18 2F01 BTN 0.01302 0.45454 None
19 4LSJ LSJ 0.001934 0.45435 None
20 1XMV ADP 0.009186 0.45418 None
21 1KDK DHT 0.002239 0.45321 None
22 4NVP 7CH 0.005638 0.4509 None
23 1VDC FAD 0.01045 0.44893 None
24 1C0I FAD 0.0103 0.4476 None
25 1C0I BE2 0.0103 0.4476 None
26 3VPD ANP 0.002777 0.44703 None
27 1KYV RBF 0.002086 0.44679 None
28 4NPT 017 0.001574 0.4426 None
29 1KHT AMP 0.001371 0.44242 None
30 4FR3 LYS ARG ARG LYS SEP VAL 0.02463 0.44218 None
31 1H9G COA MYR 0.005662 0.4406 None
32 1Q6O LG6 0.00271 0.43941 None
33 3IBH GSH 0.003815 0.43875 None
34 1QB7 ADE 0.002014 0.43785 None
35 3I6B KDO 0.001501 0.43765 None
36 3PJU C2E 0.006584 0.43747 None
37 3K3K A8S 0.004093 0.43734 None
38 1OAA OAA 0.01618 0.43593 None
39 4W97 UCA 0.006509 0.43472 None
40 1D6H COA 0.01806 0.4335 None
41 2C4I BTN 0.003686 0.43333 None
42 4M37 SAH 0.005145 0.43273 None
43 4C0X FMN 0.008445 0.43229 None
44 4M5P MLA 0.00442 0.43093 None
45 4C0X AQN 0.01165 0.43079 None
46 1PR9 NAP 0.01307 0.43068 None
47 1GEX PLP HSA 0.00856 0.43057 None
48 2F7C CCU 0.002118 0.42792 None
49 1SOW NAD 0.01508 0.4265 None
50 4FR3 0V4 0.04847 0.42642 None
51 2B82 ADN 0.007939 0.42575 None
52 4AF0 MOA 0.01024 0.42538 None
53 1B8U NAD 0.008093 0.42536 None
54 1B8U OAA 0.0159 0.42536 None
55 4AF5 CIT 0.002031 0.42525 None
56 1SSQ CYS 0.02977 0.42448 None
57 2QS8 MET 0.01419 0.42414 None
58 1H6W SER LEU ASN TYR ILE ILE LYS VAL LYS GLU 0.03473 0.42329 None
59 1TRD PGH 0.004886 0.4232 None
60 1NN5 ANP 0.01578 0.42314 None
61 1NN5 2DT 0.01578 0.42314 None
62 1C3V NDP 0.01724 0.42248 None
63 2DTX BMA 0.02552 0.42236 None
64 3C1O NAP 0.01188 0.42232 None
65 3D3W NAP 0.01787 0.42171 None
66 1UQX MMA 0.01225 0.42168 None
67 2YK7 CSF 0.00895 0.42156 None
68 1FDJ 2FP 0.005574 0.42063 None
69 2NLI FMN 0.04946 0.41964 None
70 1MDZ PLP 0.02092 0.41953 None
71 2Q2V NAD 0.02216 0.4194 None
72 2D37 NAD 0.01673 0.41939 None
73 1DR1 NAP 0.0271 0.41917 None
74 1DR1 HBI 0.0271 0.41917 None
75 1POC GEL 0.00847 0.4189 None
76 3OIG IMJ 0.02313 0.41848 None
77 3P0K FAD 0.01256 0.41808 None
78 4NES UD1 0.009748 0.41801 None
79 2AG8 NAP 0.01183 0.41766 None
80 4HGP KDO 0.02766 0.41674 None
81 1MDZ DCS 0.02525 0.41661 None
82 2DTJ THR 0.006094 0.41644 None
83 4DVE BTN 0.006092 0.41644 None
84 1IM8 SAI 0.01266 0.41628 None
85 1CL2 PPG 0.01166 0.41623 None
86 1AX2 NDG GAL 0.004668 0.41611 None
87 4C1K PEP 0.004689 0.41602 None
88 1C3V PDC 0.004031 0.41582 None
89 2HGZ PBF 0.01634 0.41573 None
90 1UZN NAP 0.008988 0.41569 None
91 3IOI 1GW 0.02544 0.41534 None
92 4IAE 1DX 0.0495 0.41528 None
93 4JP3 CIT 0.007404 0.41509 None
94 2JAR UMP 0.01129 0.41506 None
95 2WIC GNP 0.01638 0.41494 None
96 1SNY NAP 0.01976 0.41457 None
97 3RKR NAP 0.006745 0.41447 None
98 3GWT 066 0.02518 0.41443 None
99 2BNE U5P 0.02954 0.41377 None
100 1JCM 137 0.02394 0.41311 None
101 2BNF UTP 0.0386 0.41238 None
102 1JUV NDP 0.02213 0.41221 None
103 3BW2 FMN 0.02704 0.41174 None
104 3R35 4CO 0.02865 0.41168 None
105 4JEJ 1GP 0.009361 0.41051 None
106 3RGG AIR 0.008295 0.41047 None
107 1QCA FUA 0.03213 0.40865 None
108 3LTW HLZ 0.002151 0.40851 None
109 2YBQ UP2 0.04248 0.4084 None
110 3QP4 HL0 0.01308 0.40825 None
111 4E1N TQX 0.02034 0.40821 None
112 1FDJ 13P 0.00521 0.40772 None
113 4CS4 ANP 0.04641 0.40741 None
114 4NES UDP 0.01568 0.4066 None
115 1UO4 PIH 0.0007865 0.40625 None
116 1NU4 MLA 0.02144 0.40569 None
117 4PO2 ASN ARG LEU LEU LEU THR GLY 0.027 0.40532 None
118 2QLX RM4 0.00503 0.40482 None
119 3ZZS TRP 0.04888 0.40437 None
120 1A8R GTP 0.02105 0.40425 None
121 1GV0 NAD 0.03889 0.404 None
122 1ULE GLA GAL NAG 0.007609 0.40386 None
123 3WUC GLC GAL 0.006744 0.40292 None
124 3LEO GSH 0.03973 0.40238 None
125 4Q3F TLA 0.01243 0.40013 None
126 3ZUY TCH 0.01404 0.40025 1.23839
127 1A59 COA 0.0001693 0.49909 2.8169
128 2CSN CKI 0.0005649 0.48667 2.8169
129 1RYI FAD 0.001721 0.48297 2.8169
130 2R40 EPH 0.001694 0.47075 2.8169
131 2YPO PHE 0.001893 0.46773 2.8169
132 2BJK NAD 0.007909 0.45867 2.8169
133 1RYI GOA 0.008281 0.45063 2.8169
134 1I9G SAM 0.0119 0.44439 2.8169
135 1QRD FAD 0.003948 0.44337 2.8169
136 4K5S FAD 0.009446 0.4376 2.8169
137 4BCS BTN 0.002973 0.43758 2.8169
138 2R40 20E 0.006127 0.43596 2.8169
139 1JQI FAD 0.01314 0.43383 2.8169
140 3MAG 3MA 0.003904 0.43355 2.8169
141 1EXB NDP 0.04212 0.43023 2.8169
142 1ZUW DGL 0.002678 0.4296 2.8169
143 4B9E FAH 0.001425 0.42801 2.8169
144 4BI7 PGA 0.003419 0.42492 2.8169
145 4KQL 1SG 0.04505 0.42423 2.8169
146 1R18 SAH 0.01096 0.42086 2.8169
147 2OWZ F6P 0.007761 0.42065 2.8169
148 4K5S PM0 0.03916 0.42022 2.8169
149 1R37 NAD 0.02738 0.41593 2.8169
150 1JQI CAA 0.01756 0.41424 2.8169
151 3H22 B53 0.006912 0.414 2.8169
152 4IU0 ABH 0.0163 0.41275 2.8169
153 3HZS M0E 0.04666 0.41082 2.8169
154 2Q8M AMP 0.01053 0.40821 2.8169
155 2OWZ CIT 0.02077 0.40778 2.8169
156 1LC8 33P 0.02886 0.40665 2.8169
157 3MCT SAH 0.02046 0.4065 2.8169
158 3TKA CTN 0.0001875 0.53738 4.22535
159 1QY1 PRZ 0.002279 0.45103 4.22535
160 3FED BIX 0.001712 0.45072 4.22535
161 1OGD RIP 0.0007975 0.44966 4.22535
162 4AT0 FAD 0.01463 0.44146 4.22535
163 3U4C NDP 0.006886 0.4393 4.22535
164 2EFJ SAH 0.003567 0.43612 4.22535
165 4KQI NIO 0.009078 0.43606 4.22535
166 4KQI RBZ 0.009078 0.43606 4.22535
167 3QP6 HL6 0.003062 0.43472 4.22535
168 1RYD GLC 0.001464 0.43135 4.22535
169 2J7T 274 0.01028 0.4309 4.22535
170 4JK3 NAD 0.0117 0.42818 4.22535
171 3W54 RNB 0.004508 0.42712 4.22535
172 1LYX PGA 0.004867 0.42562 4.22535
173 1FMB HYB 0.004397 0.42526 4.22535
174 3IB8 AMP 0.005491 0.42325 4.22535
175 4LWM MHO 0.02799 0.42198 4.22535
176 1DKU AP2 0.01444 0.4218 4.22535
177 4LTN NAI 0.03852 0.41985 4.22535
178 1F3F D4T 0.04889 0.41927 4.22535
179 1F3F D4D 0.02578 0.41927 4.22535
180 1FP1 HCC 0.01048 0.41657 4.22535
181 4HA6 FAD 0.04344 0.41406 4.22535
182 1FP1 SAH 0.01169 0.41049 4.22535
183 1VJO PLP 0.01458 0.40609 4.22535
184 1OTH PAO 0.03973 0.40578 4.22535
185 1WHT BZS 0.006332 0.40409 4.22535
186 4QDC ASD 0.03494 0.40326 4.22535
187 3WE0 FAD 0.001168 0.49347 5.6338
188 1LDM NAD 0.006982 0.46813 5.6338
189 1IUP ALQ 0.002272 0.4639 5.6338
190 2J07 HDF 0.006084 0.46174 5.6338
191 2J07 FAD 0.006084 0.46174 5.6338
192 1VJT NAD 0.001261 0.46102 5.6338
193 1QPB TPP 0.002466 0.45784 5.6338
194 1QPB PYM 0.002466 0.45784 5.6338
195 3T31 FAD 0.009097 0.45665 5.6338
196 3WBF API 0.004562 0.45307 5.6338
197 4OYA 1VE 0.02953 0.44874 5.6338
198 2WUF KEM 0.003178 0.44781 5.6338
199 3WBF NAP 0.004926 0.44631 5.6338
200 4O1M NAD 0.005873 0.44396 5.6338
201 2E2R 2OH 0.007412 0.44392 5.6338
202 1VQ2 DDN 0.002478 0.44337 5.6338
203 1QF5 GDP 0.01387 0.44265 5.6338
204 1QF5 RPL 0.01387 0.44265 5.6338
205 4LXH C1E 0.002578 0.44258 5.6338
206 3IU9 T07 0.02007 0.44088 5.6338
207 2VAR ANP 0.004509 0.43722 5.6338
208 3PC3 P1T 0.005259 0.4341 5.6338
209 1P72 ADP 0.0117 0.4307 5.6338
210 2VAR KDG 0.003467 0.42989 5.6338
211 1U7Z PMT 0.01602 0.42634 5.6338
212 4IOK ADP 0.0116 0.4257 5.6338
213 4IOK XPO 0.009359 0.4257 5.6338
214 1R6D DAU 0.03399 0.42556 5.6338
215 4C0C WVH 0.03264 0.42124 5.6338
216 1R6D NAD 0.04345 0.42066 5.6338
217 1BGQ RDC 0.01519 0.42007 5.6338
218 1O7N IND 0.01179 0.41938 5.6338
219 4A6D SAM 0.01093 0.41752 5.6338
220 3CQD ATP 0.03345 0.41458 5.6338
221 3PNL ADP 0.01499 0.41446 5.6338
222 3RO7 TDR 0.02389 0.41191 5.6338
223 3WO0 ADP 0.03863 0.41048 5.6338
224 3WO0 ALA 0.03863 0.41048 5.6338
225 3MMR ABH 0.02331 0.40977 5.6338
226 3TN7 NJP 0.03558 0.40705 5.6338
227 1V7R CIT 0.01479 0.40541 5.6338
228 1P72 THM 0.008656 0.40436 5.6338
229 3U1T MLI 0.006218 0.40091 5.6338
230 1PTR PRB 0.006139 0.40115 6
231 2HMT NAI 0.001295 0.49506 7.04225
232 3NKS FAD 0.001104 0.48814 7.04225
233 2HVW DDN 0.0002852 0.48125 7.04225
234 1Z44 NPO 0.0007375 0.4806 7.04225
235 1E7S NAP 0.001538 0.47483 7.04225
236 3MBG FAD 0.001504 0.46648 7.04225
237 1NW5 SAM 0.000962 0.46647 7.04225
238 1LVL FAD 0.005254 0.4606 7.04225
239 1YBH FAD 0.00491 0.45817 7.04225
240 3NYQ MCA 0.004113 0.45404 7.04225
241 3UER BTU 0.001126 0.45178 7.04225
242 3UER TUR 0.001126 0.45178 7.04225
243 1UKW FAD 0.006021 0.45168 7.04225
244 2HGS ADP 0.002583 0.45031 7.04225
245 1Q0H NDP 0.01014 0.4496 7.04225
246 3OND ADN 0.01079 0.44822 7.04225
247 3OND NAD 0.01079 0.44822 7.04225
248 1P9B HDA 0.00075 0.44744 7.04225
249 2PUL ACP 0.001879 0.44664 7.04225
250 1YBH P22 0.006813 0.44212 7.04225
251 3NYQ AMP 0.007949 0.44128 7.04225
252 1P9B IMO 0.005922 0.43666 7.04225
253 2FWP CIT 0.008938 0.43639 7.04225
254 4CMF PXG 0.02057 0.43541 7.04225
255 2WE5 ADP 0.003129 0.43429 7.04225
256 1V1A ADP 0.009458 0.43265 7.04225
257 1LVL NAD 0.00576 0.43226 7.04225
258 2HGS GSH 0.003747 0.43075 7.04225
259 1ZGA HMK 0.003462 0.42991 7.04225
260 2AMV BIN 0.02701 0.42931 7.04225
261 4BMO FMN 0.009894 0.42757 7.04225
262 4USQ FAD 0.01759 0.42544 7.04225
263 2YHW BM3 0.0144 0.42508 7.04225
264 3V1U NAD 0.01133 0.42477 7.04225
265 3EM1 TYD 0.01122 0.42274 7.04225
266 1ZGA SAH 0.007189 0.41795 7.04225
267 2Q8H TF4 0.005496 0.41777 7.04225
268 1GS5 NLG 0.0271 0.41509 7.04225
269 1GS5 ANP 0.0271 0.41509 7.04225
270 1TDF FAD 0.04615 0.41504 7.04225
271 2HJ3 FAD 0.01404 0.41417 7.04225
272 1Q0H FOM 0.04776 0.41351 7.04225
273 1QR0 COA 0.007264 0.41304 7.04225
274 1GVF PGH 0.005812 0.41194 7.04225
275 3GE7 AFQ 0.03216 0.4114 7.04225
276 3CXO 1N5 0.03133 0.40977 7.04225
277 1I7Z COC 0.01193 0.40797 7.04225
278 3S7O LBV 0.03448 0.40771 7.04225
279 4LBP 1WG 0.03092 0.4077 7.04225
280 1UJ2 C5P 0.02611 0.40741 7.04225
281 2HVW DCP 0.01362 0.40536 7.04225
282 3NKS ACJ 0.01539 0.40502 7.04225
283 2V9M CIT 0.01129 0.40448 7.04225
284 3CXO 3LR 0.0362 0.40435 7.04225
285 1P9B GDP 0.01772 0.40415 7.04225
286 4U9W COA 0.02099 0.40076 7.04225
287 4KCF AKM 0.0002103 0.50328 8.4507
288 1SS4 CIT 0.0008126 0.48727 8.4507
289 3BAZ NAP 0.0008598 0.47801 8.4507
290 2AE2 NAP 0.002344 0.47522 8.4507
291 2AE2 PTO 0.002344 0.47522 8.4507
292 3F3E LEU 0.002124 0.47409 8.4507
293 1GSA ADP 0.00448 0.46767 8.4507
294 1BUC CAA 0.001517 0.46465 8.4507
295 1KBI FMN 0.002547 0.45717 8.4507
296 1KBI PYR 0.002547 0.45717 8.4507
297 2GSD NAD 0.00447 0.45586 8.4507
298 1QS8 IVA VAL VAL STA ALA STA 0.002311 0.45257 8.4507
299 2YVF NAD 0.01325 0.45225 8.4507
300 2YVF FAD 0.01288 0.45225 8.4507
301 4AQL TXC 0.001682 0.45107 8.4507
302 2XCG XCG 0.005128 0.44681 8.4507
303 1Q3Q ANP 0.01514 0.44659 8.4507
304 2H6B 3C4 0.004113 0.44572 8.4507
305 4BAS GNP 0.00361 0.44172 8.4507
306 4G10 GSH 0.002528 0.44078 8.4507
307 2V7T SAH 0.03714 0.43989 8.4507
308 4G28 0W8 0.001573 0.43979 8.4507
309 3HY3 10F 0.005434 0.43684 8.4507
310 4MZ7 DTP 0.008962 0.43508 8.4507
311 2RDT FMN 0.02399 0.43482 8.4507
312 2RDT 2RD 0.03149 0.43482 8.4507
313 2BGM NAJ 0.02637 0.43401 8.4507
314 1UWZ THU 0.003722 0.43314 8.4507
315 1LL2 UPG 0.005982 0.43149 8.4507
316 2BLE 5GP 0.03361 0.42976 8.4507
317 1SB8 UD2 0.02875 0.42934 8.4507
318 2YC5 6BC 0.01612 0.42838 8.4507
319 1RKD RIB 0.01532 0.42616 8.4507
320 1RKD ADP 0.01532 0.42616 8.4507
321 3EE4 MYR 0.009255 0.42264 8.4507
322 4KCF FMN 0.005064 0.4225 8.4507
323 2G86 UMP 0.03662 0.42173 8.4507
324 3OZG SSI 0.006716 0.42147 8.4507
325 1BUC FAD 0.02317 0.42057 8.4507
326 1DSS NAD 0.01415 0.42015 8.4507
327 4MZ7 DGT 0.01835 0.41996 8.4507
328 3A2Q ACA ACA 0.008296 0.41932 8.4507
329 3AYS CT3 0.005281 0.41921 8.4507
330 6FIV 3TL 0.007156 0.41804 8.4507
331 1SS4 GSH 0.01484 0.41756 8.4507
332 1WNG SAH 0.01122 0.417 8.4507
333 3LST SAH 0.006802 0.41675 8.4507
334 2NW9 FT6 0.004016 0.41589 8.4507
335 1OMZ UD2 0.04272 0.41444 8.4507
336 1GSA GSH 0.0397 0.41441 8.4507
337 1SB8 NAD 0.04996 0.41399 8.4507
338 5YAS FAC 0.007019 0.4137 8.4507
339 2QA1 FAD 0.033 0.41292 8.4507
340 4UBP HAE 0.01469 0.41241 8.4507
341 1R27 MGD 0.03729 0.41125 8.4507
342 3UIE ANP 0.009249 0.40835 8.4507
343 2X61 CH 0.04831 0.40833 8.4507
344 1KBJ FMN 0.02505 0.40827 8.4507
345 3UH0 TSB 0.02228 0.40785 8.4507
346 1Z45 NAD 0.03284 0.40761 8.4507
347 1JGS SAL 0.0004585 0.40726 8.4507
348 1Y13 BIO 0.009834 0.40717 8.4507
349 4QVH COA 0.03186 0.40521 8.4507
350 2FFC U5P 0.0185 0.40513 8.4507
351 2B4Q NAP 0.03776 0.40463 8.4507
352 3M6W SAM 0.0159 0.40437 8.4507
353 2VHJ ADP 0.0217 0.40364 8.4507
354 1YGC 905 0.01083 0.41771 9.52381
355 2CKM AA7 0.001948 0.48027 9.85915
356 1TOI HCI 0.002102 0.46411 9.85915
357 1J5P NAD 0.002958 0.45555 9.85915
358 1TB4 PEJ 0.006092 0.44319 9.85915
359 4NE2 ADP 0.007642 0.44211 9.85915
360 1V35 NAI 0.01179 0.44108 9.85915
361 4P05 4NS 0.004254 0.44016 9.85915
362 2GJ3 FAD 0.003817 0.43874 9.85915
363 1PFK ADP 0.003111 0.43668 9.85915
364 1PFK FBP 0.002289 0.43537 9.85915
365 1X54 4AD 0.006321 0.43532 9.85915
366 1KOL NAD 0.01306 0.43395 9.85915
367 4LWA Q13 0.01692 0.43133 9.85915
368 2PTZ PAH 0.004519 0.42931 9.85915
369 3B96 FAD 0.01711 0.42914 9.85915
370 3O03 GCO 0.00448 0.42725 9.85915
371 4IVG ANP 0.02967 0.4272 9.85915
372 4Q3R XA2 0.01101 0.42537 9.85915
373 3MPI GRA 0.03665 0.42453 9.85915
374 3MPI FAD 0.01928 0.42453 9.85915
375 4PLG OXM 0.02119 0.42451 9.85915
376 4PLG NAI 0.02119 0.42451 9.85915
377 3LZW NAP 0.04255 0.42372 9.85915
378 4FGC PQ0 0.002709 0.4233 9.85915
379 4UAL 3FV 0.007264 0.42196 9.85915
380 1ZK7 FAD 0.0336 0.42139 9.85915
381 3ZPG 5GP 0.004799 0.4205 9.85915
382 1XHL NDP 0.0208 0.41965 9.85915
383 1QS0 TDP 0.01026 0.41881 9.85915
384 2Q97 ATP 0.0124 0.41835 9.85915
385 2NX1 PEP 0.01818 0.41764 9.85915
386 3LZW FAD 0.03048 0.41755 9.85915
387 3GEG NAD 0.019 0.41672 9.85915
388 3B96 MYA 0.0121 0.41548 9.85915
389 2NX1 RP5 0.02055 0.41507 9.85915
390 3O03 NAP 0.02008 0.41425 9.85915
391 4NE2 SH2 0.03424 0.41212 9.85915
392 3CKZ ZMR 0.04944 0.40953 9.85915
393 3A8U PLP 0.02253 0.40908 9.85915
394 3ULK NDP 0.02384 0.40495 9.85915
395 3KJI ADP 0.01643 0.40372 9.85915
396 3K56 IS3 0.01699 0.401 9.85915
397 3EQ9 X97 0.03043 0.40059 9.85915
398 4KXV TDP DX5 0.001957 0.47697 11.2676
399 1GAD NAD 0.001127 0.47406 11.2676
400 1TUF AZ1 0.001586 0.46373 11.2676
401 1CBF SAH 0.0009119 0.46092 11.2676
402 2V6O FAD 0.01368 0.45745 11.2676
403 1UXG NAD 0.005083 0.45639 11.2676
404 1UXG FUM 0.005083 0.45639 11.2676
405 4DQ2 BTX 0.004856 0.44661 11.2676
406 2C7G FAD 0.01537 0.44556 11.2676
407 2IXB NAD 0.006229 0.44401 11.2676
408 1XVV CCQ 0.01017 0.4424 11.2676
409 1XOC VAL ASP SER LYS ASN THR SER SER TRP 0.01138 0.44091 11.2676
410 3B20 NAD 0.005353 0.44028 11.2676
411 3HPF GAE 0.009481 0.43977 11.2676
412 2WQP WQP 0.006417 0.438 11.2676
413 1DLJ NAI 0.01976 0.43631 11.2676
414 1DLJ UGA 0.01976 0.43631 11.2676
415 2C7G ODP 0.02512 0.43378 11.2676
416 2IXB A2G 0.01666 0.4307 11.2676
417 2J8Z NAP 0.01108 0.42933 11.2676
418 3ZOD FMN 0.01 0.42877 11.2676
419 3ZOD HQE 0.01 0.42877 11.2676
420 1WL4 COA 0.02441 0.42685 11.2676
421 2XK9 XK9 0.01686 0.42635 11.2676
422 1O68 KIV 0.002963 0.42475 11.2676
423 4W6Z 8ID 0.02197 0.42273 11.2676
424 2DDH FAD 0.02408 0.41762 11.2676
425 4Q9N NAI 0.0239 0.41462 11.2676
426 3F81 STT 0.00761 0.41123 11.2676
427 8CAT NDP 0.01922 0.40777 11.2676
428 3BL6 FMC 0.01763 0.4061 11.2676
429 2GDZ NAD 0.03761 0.40472 11.2676
430 1Y2W NAG 0.006889 0.40252 11.2676
431 2HXT EHM 0.01733 0.40061 11.2676
432 1V7W NAG 0.01568 0.40042 11.2676
433 1V7W NDG 0.01568 0.40042 11.2676
434 3IL6 B83 0.0009242 0.46727 12.6761
435 2HW1 ANP 0.001761 0.45625 12.6761
436 4U36 TNR 0.002317 0.45595 12.6761
437 1H2B NAJ 0.005601 0.44871 12.6761
438 1ZFJ IMP 0.01133 0.44375 12.6761
439 1JIL 485 0.004674 0.43466 12.6761
440 2QXX TTP 0.01232 0.43416 12.6761
441 1UOU CMU 0.00448 0.42724 12.6761
442 2P8O BVA 0.006822 0.42321 12.6761
443 1M7Y PPG 0.01727 0.42125 12.6761
444 4G4S LDZ 0.00772 0.42075 12.6761
445 4HZO COA 0.004298 0.41768 12.6761
446 2AEB ABH 0.01658 0.41686 12.6761
447 3TO7 COA 0.03192 0.41654 12.6761
448 1NML CIT 0.005411 0.4133 12.6761
449 2HW1 FRU 0.00556 0.40977 12.6761
450 4OJ8 AKG 0.01947 0.40584 12.6761
451 1WGC SIA GAL BGC 0.01572 0.40412 12.6761
452 3E5P PPI 0.03559 0.40391 12.6761
453 3BY8 MLT 0.005407 0.40349 12.6761
454 2OD9 A1R NCA 0.04134 0.4027 12.6761
455 1LCP PLU 0.0353 0.4011 12.6761
456 1AUA BOG 0.01055 0.40059 12.6761
457 1HDR NAD 0.0009242 0.50344 14.0845
458 1X1T NAD 0.003702 0.48641 14.0845
459 2C31 ADP 0.006407 0.47381 14.0845
460 2XVE FAD 0.009672 0.45941 14.0845
461 2C31 TZD 0.01854 0.44986 14.0845
462 3SQG TP7 0.001753 0.44801 14.0845
463 1L1Q 9DA 0.003359 0.44131 14.0845
464 2VBQ BSJ 0.0103 0.4369 14.0845
465 1EZV UQ6 0.00502 0.43679 14.0845
466 2H6T IVA VAL VAL STA ALA STA 0.003798 0.43488 14.0845
467 2ZB3 NDP 0.01088 0.42971 14.0845
468 3FC2 IBI 0.01215 0.42866 14.0845
469 4HZD COA 0.01599 0.42855 14.0845
470 1EZV SMA 0.01046 0.42785 14.0845
471 3ZLM ANP 0.006294 0.42679 14.0845
472 3Q9T FAY 0.0201 0.42663 14.0845
473 1A69 FMB 0.04597 0.42376 14.0845
474 4CKL SM8 0.0093 0.42254 14.0845
475 3UR0 SVR 0.03358 0.4206 14.0845
476 1WVG APR 0.01409 0.42024 14.0845
477 1G8S MET 0.001382 0.41547 14.0845
478 1WVG CXY 0.018 0.41071 14.0845
479 4JRB PGT 0.01048 0.4083 14.0845
480 1FS5 TLA 0.02941 0.40689 14.0845
481 1M5B BN1 0.003016 0.48291 15.493
482 1Q3P GLU ALA GLN THR ARG LEU 0.001895 0.44647 15.493
483 3DAG FEG 0.005028 0.44158 15.493
484 1WUR 8DG 0.00436 0.43966 15.493
485 1QH9 LAC 0.001312 0.43339 15.493
486 3PFG SAM 0.02042 0.42816 15.493
487 3PFG TLO 0.02042 0.42816 15.493
488 2EWM NAD 0.01567 0.42451 15.493
489 2QDT I38 0.006005 0.42368 15.493
490 4GYW UDP 0.0174 0.42344 15.493
491 4F2Q QUS 0.007981 0.4159 15.493
492 1OLS TDP 0.04283 0.41517 15.493
493 3QO8 SSA 0.01075 0.41215 15.493
494 3VKX T3 0.01506 0.4119 15.493
495 1L2T ATP 0.02286 0.40732 15.493
496 4LCQ URQ 0.0444 0.4 15.493
497 4O8A FAD 0.001987 0.46809 16.9014
498 4G1V FAD 0.00309 0.45464 16.9014
499 2PT9 2MH 0.006116 0.44802 16.9014
500 1TIW FAD 0.008271 0.44587 16.9014
501 1TIW TFB 0.008271 0.44587 16.9014
502 2PT9 S4M 0.01249 0.42275 16.9014
503 4NTD FAD 0.04329 0.40985 16.9014
504 3TDC 0EU 0.01509 0.40737 16.9014
505 1UMP SQA 0.0293 0.405 16.9014
506 4RJK PYR 0.007784 0.40342 16.9014
507 4O8A 2OP 0.002075 0.40116 16.9014
508 3DDC GNP 0.001807 0.4627 18.3099
509 3PVT 3HC 0.009611 0.44161 18.3099
510 2QF7 AGS 0.008384 0.43244 18.3099
511 2CE7 ADP 0.003543 0.43185 18.3099
512 1REO FAD 0.0191 0.42869 18.3099
513 1QW9 KHP 0.01055 0.42623 18.3099
514 1FP2 HMO 0.007683 0.4188 18.3099
515 1VBH PEP 0.004938 0.412 18.3099
516 4LFL TG6 0.00851 0.40997 18.3099
517 5FIT AP2 0.01496 0.40133 18.3099
518 4NM5 ADP 0.004557 0.43876 19.7183
519 9LDB NAD 0.008007 0.43871 19.7183
520 9LDT NAD 0.01618 0.42382 19.7183
521 3ZRR PXG 0.008292 0.42311 19.7183
522 1F8F NAD 0.04428 0.42089 19.7183
523 2D0V PQQ 0.009976 0.41937 19.7183
524 3TXO 07U 0.007656 0.41672 19.7183
525 3ZGE ASP 0.003591 0.40229 19.7183
526 1FIQ FAD 0.004566 0.45425 21.1268
527 1FIQ SAL 0.005669 0.44725 21.1268
528 1FIQ MTE 0.01167 0.42951 21.1268
529 2F5T MAL 0.009489 0.41856 21.1268
530 3LM9 FRU 0.01814 0.41358 21.1268
531 2Q1S NAI 0.04574 0.41291 21.1268
532 4EPL JAI 0.01062 0.41238 21.1268
533 2R14 FMN 0.02538 0.40934 21.1268
534 2R14 TXD 0.03196 0.40934 21.1268
535 5IBP ACE ASP GLU VAL ASP 0QE 0.02682 0.40252 21.1268
536 2PWY SAH 0.006212 0.4341 22.5352
537 1G7V PAI 0.02532 0.42254 22.5352
538 2WM1 13P 0.006408 0.41008 22.5352
539 4IS0 GDS 0.01351 0.40958 22.5352
540 4IS0 1R4 0.01976 0.4088 22.5352
541 3ZY6 GFB 0.02571 0.40183 22.5352
542 1G0N PHH 0.008459 0.44832 23.9437
543 1G0N NDP 0.01439 0.43388 23.9437
544 2P41 SAH 0.0007203 0.47015 25.3521
545 1CKN GTP 0.006251 0.41334 25.3521
546 2W1A TSA 0.001169 0.44835 26.7606
547 1ECC PCP 0.004527 0.44057 28.169
548 1IYE PGU 0.0209 0.4184 28.169
549 4R3L COA 0.009421 0.41578 28.169
550 1ZED PNP 0.005929 0.40179 28.169
551 2I4O ATP 0.004571 0.422 29.5775
552 1EP2 ORO 0.002389 0.46804 36.6197
553 1EP2 FMN 0.001729 0.46672 36.6197
554 1EP2 FAD 0.004503 0.44068 36.6197
555 1YAG ATP 0.005334 0.43722 42.2535
Pocket No.: 2; Query (leader) PDB : 3SJ0; Ligand: DXC; Similar sites found: 3
This union binding pocket(no: 2) in the query (biounit: 3sj0.bio1) has 11 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 3NWQ 2NC 0.02131 0.42552 None
2 2FXD DR7 0.02694 0.41361 None
3 3F7Z 34O 0.02545 0.40004 19.7183
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