Receptor
PDB id Resolution Class Description Source Keywords
4ZGS 2.46 Å EC: 1.-.-.- IDENTIFICATION OF THE PYRUVATE REDUCTASE OF CHLAMYDOMONAS RE CHLAMYDOMONAS REINHARDTII PYRUVATE DEHYDROGENASE FERMENTATION GREEN ALGA BIOHYDROGEOXIDOREDUCTASE
Ref.: IDENTIFICATION OF THE ELUSIVE PYRUVATE REDUCTASE OF CHLAMYDOMONAS REINHARDTII CHLOROPLASTS. PLANT CELL.PHYSIOL. V. 57 82 2016
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
NAD H:1000;
F:1000;
C:1000;
B:1000;
D:1000;
G:1000;
A:1000;
E:1000;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
663.425 C21 H27 N7 O14 P2 c1cc(...
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90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
4ZGS 2.46 Å EC: 1.-.-.- IDENTIFICATION OF THE PYRUVATE REDUCTASE OF CHLAMYDOMONAS RE CHLAMYDOMONAS REINHARDTII PYRUVATE DEHYDROGENASE FERMENTATION GREEN ALGA BIOHYDROGEOXIDOREDUCTASE
Ref.: IDENTIFICATION OF THE ELUSIVE PYRUVATE REDUCTASE OF CHLAMYDOMONAS REINHARDTII CHLOROPLASTS. PLANT CELL.PHYSIOL. V. 57 82 2016
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 280 families.
1 4ZGS - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 247 families.
1 4ZGS - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 177 families.
1 4ZGS - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: NAD; Similar ligands found: 220
No: Ligand ECFP6 Tc MDL keys Tc
1 A3D 0.872727 0.986111
2 NAD IBO 0.845455 0.933333
3 NHD 0.821429 0.972222
4 NAP 0.811966 0.986111
5 NAJ PYZ 0.803419 0.910256
6 NFD 0.791304 0.946667
7 NXX 0.765766 0.972603
8 DND 0.765766 0.972603
9 ZID 0.737705 0.986111
10 NAQ 0.729508 0.934211
11 NAE 0.721311 0.959459
12 NA0 0.712 0.972603
13 TAP 0.704 0.921053
14 AMP NAD 0.696 0.945946
15 NDE 0.689922 0.972603
16 NAJ 0.683333 0.972222
17 NDC 0.679389 0.934211
18 NDO 0.674603 0.958904
19 N01 0.656 0.972222
20 CNA 0.642276 0.972603
21 NBP 0.621212 0.922078
22 NAD BBN 0.609929 0.876543
23 8ID 0.609756 0.922078
24 NAD CJ3 0.601399 0.845238
25 ADP MG 0.579439 0.918919
26 A2D 0.576923 0.958333
27 ADP 0.575472 0.931507
28 NGD 0.574803 0.922078
29 BEF ADP 0.574074 0.894737
30 ADP BEF 0.574074 0.894737
31 BA3 0.566038 0.958333
32 NAD NDT 0.565789 0.755319
33 M33 0.564815 0.918919
34 ADP PO3 0.563636 0.957747
35 B4P 0.560748 0.958333
36 AP5 0.560748 0.958333
37 ATP MG 0.558559 0.918919
38 AN2 0.555556 0.918919
39 GAP 0.553571 0.932432
40 OOB 0.551724 0.972222
41 CA0 0.550459 0.932432
42 ATP 0.545455 0.931507
43 ACP 0.545455 0.906667
44 NAD TDB 0.544872 0.70297
45 ADP ALF 0.54386 0.883117
46 ALF ADP 0.54386 0.883117
47 5FA 0.540541 0.931507
48 AQP 0.540541 0.931507
49 APR 0.540541 0.931507
50 AR6 0.540541 0.931507
51 ANP MG 0.53913 0.907895
52 VO4 ADP 0.53913 0.945205
53 ADP VO4 0.53913 0.945205
54 AGS 0.535714 0.883117
55 SAP 0.535714 0.883117
56 AD9 0.535714 0.906667
57 WAQ 0.533333 0.896104
58 ABM 0.53271 0.905405
59 00A 0.529412 0.921053
60 DLL 0.529412 0.972222
61 ANP 0.526316 0.906667
62 NJP 0.526316 0.959459
63 ACQ 0.526316 0.906667
64 OAD 0.525 0.932432
65 AMP MG 0.523364 0.905405
66 ADX 0.522523 0.839506
67 5AL 0.521739 0.945205
68 A1R 0.521008 0.871795
69 9SN 0.520325 0.909091
70 AMP 0.518868 0.930556
71 A 0.518868 0.930556
72 50T 0.517857 0.893333
73 ATF 0.517241 0.894737
74 DAL AMP 0.516949 0.945205
75 3OD 0.516393 0.932432
76 1ZZ 0.516393 0.851852
77 SON 0.513514 0.92
78 PRX 0.513274 0.881579
79 SRP 0.512821 0.92
80 ADP BMA 0.512397 0.932432
81 3UK 0.512397 0.958904
82 MYR AMP 0.512195 0.851852
83 NAJ PZO 0.510949 0.909091
84 NMN 0.509434 0.875
85 AMP DBH 0.507937 0.906667
86 A22 0.504202 0.945205
87 FA5 0.504 0.945946
88 ATP A A A 0.504 0.971831
89 TYR AMP 0.5 0.945946
90 8QN 0.5 0.945205
91 NAX 0.496183 0.886076
92 PR8 0.495935 0.8625
93 PAJ 0.495868 0.873418
94 4AD 0.495868 0.933333
95 AMO 0.495868 0.92
96 ADQ 0.495868 0.932432
97 A12 0.495495 0.894737
98 AP2 0.495495 0.894737
99 ALF ADP 3PG 0.492424 0.873418
100 LA8 ALF 3PG 0.492424 0.873418
101 AHZ 0.492308 0.851852
102 YAP 0.492063 0.933333
103 FYA 0.491935 0.918919
104 AHX 0.491803 0.884615
105 4UU 0.488372 0.933333
106 5SV 0.487603 0.8375
107 TAT 0.487179 0.894737
108 APC 0.486957 0.894737
109 SRA 0.486239 0.881579
110 NAI 0.484848 0.921053
111 6V0 0.484848 0.909091
112 GTA 0.484615 0.898734
113 A A 0.483871 0.958333
114 LAD 0.483871 0.873418
115 AU1 0.482456 0.906667
116 TXE 0.481203 0.921053
117 AF3 ADP 3PG 0.481203 0.873418
118 OMR 0.481203 0.841463
119 LAQ 0.480916 0.851852
120 G3A 0.48062 0.909091
121 TXA 0.48 0.92
122 NB8 0.48 0.884615
123 ME8 0.48 0.851852
124 BIS 0.48 0.871795
125 PTJ 0.48 0.884615
126 139 0.477941 0.886076
127 LPA AMP 0.477273 0.851852
128 AR6 AR6 0.476923 0.958333
129 G5P 0.476923 0.909091
130 AFH 0.476923 0.873418
131 25L 0.47619 0.945205
132 25A 0.47541 0.958333
133 DZD 0.47482 0.897436
134 TXD 0.473684 0.921053
135 4UV 0.472868 0.933333
136 TYM 0.470149 0.945946
137 ADV 0.470085 0.894737
138 RBY 0.470085 0.894737
139 ARG AMP 0.469697 0.841463
140 4TA 0.467626 0.864198
141 48N 0.466165 0.884615
142 XAH 0.465116 0.851852
143 4UW 0.462687 0.897436
144 M24 0.461538 0.886076
145 IOT 0.459854 0.821429
146 T5A 0.456522 0.853659
147 EAD 0.455782 0.886076
148 MAP 0.455285 0.883117
149 BT5 0.453901 0.821429
150 A4P 0.452555 0.833333
151 UP5 0.451852 0.933333
152 PAP 0.445378 0.917808
153 AP0 0.445255 0.884615
154 4TC 0.445255 0.909091
155 YLP 0.444444 0.831325
156 P1H 0.443709 0.864198
157 AOC 0.442478 0.810811
158 Z5A 0.439189 0.833333
159 2A5 0.436975 0.857143
160 G A A A 0.43662 0.909091
161 COD 0.43662 0.802326
162 ADJ 0.435714 0.841463
163 YLC 0.434783 0.851852
164 YLB 0.434783 0.831325
165 U A G G 0.433566 0.921053
166 ATR 0.433333 0.90411
167 7MD 0.432836 0.851852
168 G5A 0.429752 0.790698
169 PO4 PO4 A A A A PO4 0.429688 0.943662
170 TAD 0.42963 0.873418
171 5AS 0.42735 0.770115
172 BTX 0.426573 0.831325
173 YLA 0.425532 0.831325
174 DSZ 0.425197 0.790698
175 NCN 0.424779 0.805556
176 UPA 0.42446 0.921053
177 VMS 0.424 0.8
178 54H 0.424 0.8
179 N0B 0.422819 0.853659
180 6AD 0.422764 0.85
181 AYB 0.422535 0.821429
182 7D3 0.422414 0.844156
183 YLY 0.421769 0.821429
184 TSB 0.420635 0.809524
185 ODP 0.41958 0.922078
186 AV2 0.419355 0.855263
187 FB0 0.419355 0.775281
188 A5A 0.419355 0.819277
189 NNR 0.419048 0.739726
190 A A A 0.418605 0.918919
191 LEU LMS 0.418605 0.793103
192 649 0.417266 0.775281
193 NMN AMP PO4 0.416667 0.933333
194 SSA 0.416 0.790698
195 P5A 0.415385 0.755556
196 LSS 0.414062 0.772727
197 A2R 0.412698 0.918919
198 52H 0.412698 0.790698
199 JB6 0.412214 0.896104
200 5N5 0.411215 0.783784
201 YSA 0.410448 0.811765
202 5CA 0.409449 0.790698
203 53H 0.409449 0.790698
204 ITT 0.408333 0.878378
205 7D4 0.408333 0.844156
206 NA7 0.407692 0.894737
207 5CD 0.407407 0.794521
208 0WD 0.406897 0.909091
209 A3P 0.40678 0.930556
210 AVV 0.40625 0.860759
211 RAB 0.40566 0.808219
212 ADN 0.40566 0.808219
213 XYA 0.40566 0.808219
214 FDA 0.405063 0.823529
215 GSU 0.40458 0.790698
216 7MC 0.404255 0.831325
217 NSS 0.403101 0.811765
218 6FA 0.402516 0.853659
219 NVA LMS 0.4 0.793103
220 PPS 0.4 0.817073
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 4ZGS; Ligand: NAD; Similar sites found: 339
This union binding pocket(no: 1) in the query (biounit: 4zgs.bio1) has 26 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 5KK4 44E 0.01376 0.42678 None
2 1PZG A3D 0.00000207 0.45646 0.906344
3 5LD5 NAD 0.00001682 0.50325 1.39665
4 1RYO OXL 0.007397 0.44662 1.52905
5 1X87 NAD 0.00002614 0.49544 1.5544
6 3S5W NAP 0.004254 0.42983 1.5544
7 1U3U NAD 0.000003385 0.42786 1.60428
8 1U3U BNF 0.000003385 0.42786 1.60428
9 1WPQ NAD 0.00005219 0.4832 1.7192
10 2DFV NAD 0.000002582 0.50612 1.72911
11 1ORR NAD 0.0001346 0.41867 1.72911
12 1OBB NAD 0.001184 0.42456 1.81347
13 4TXI FAD 0.0002637 0.41175 1.81347
14 2BRY FAD 0.0002345 0.40942 1.81347
15 1PS9 NAP 0.001642 0.40775 1.81347
16 2GVC FAD 0.0003429 0.40308 1.81347
17 1VQW FAD 0.0003682 0.40218 1.81347
18 3C7A NAD 0.02018 0.40133 1.81347
19 1JAY NAP 0.0004364 0.44943 1.88679
20 1EQ2 NAP 0.0005307 0.41197 1.93548
21 1V59 NAD 0.001581 0.45486 2.07254
22 1UP7 NAD 0.0005193 0.43335 2.07254
23 5HV7 RBL 0.01179 0.40978 2.07254
24 1Z0N BCD 0.007532 0.4408 2.08333
25 4IDC 1XX 0.0003981 0.40533 2.10843
26 4IDC NDP 0.0003981 0.40533 2.10843
27 4R5M NAP 0.000439 0.42043 2.12766
28 4R5M 4NO 0.0004505 0.41097 2.12766
29 4TQG NDP 0.0001185 0.44158 2.16718
30 1YKF NAP 0.00002607 0.4571 2.27273
31 2I3G NAP 0.00003713 0.44814 2.27273
32 1O6Z NAD 0.00001226 0.50399 2.31023
33 1GQ2 NAP 0.00002066 0.46661 2.33161
34 1P31 EPU 0.0004712 0.46051 2.33161
35 4QS9 BGC 0.008958 0.42704 2.33161
36 1P3D UMA 0.00264 0.40014 2.33161
37 1FK8 NAD 0.0003881 0.43787 2.33463
38 2Q46 NAP 0.0003273 0.42661 2.37154
39 4BVA NDP 0.00003509 0.44906 2.38806
40 4BVA T3 0.0001262 0.40063 2.38806
41 4RQU NAD 0.000006433 0.48538 2.4
42 2CFC NAD 0.0004754 0.41818 2.4
43 1SZ2 BGC 0.01485 0.42029 2.40964
44 1P0F NAP 0.00001239 0.45629 2.41287
45 5GZ6 NDP 0.0001399 0.47438 2.45399
46 5GZ6 7C3 0.0002094 0.4586 2.45399
47 3O26 NDP 0.001207 0.40059 2.57235
48 3M89 GSP 0.009975 0.41619 2.59067
49 1K3T BRZ 0.0003554 0.40389 2.59067
50 2WD7 NAP 0.0003066 0.42604 2.61194
51 1VI2 NAD 0.0003644 0.45269 2.66667
52 4GLL NAD 0.0006173 0.40075 2.67062
53 5IN4 NAP 0.03328 0.42614 2.74725
54 5IN4 GDP 0.03411 0.42479 2.74725
55 5IN4 6CK 0.03586 0.42424 2.74725
56 2PT9 S4M 0.002581 0.40608 2.80374
57 1Z6Z NAP 0.001344 0.40036 2.83688
58 2D2I NAP 0.0001602 0.46335 2.84974
59 1LJ8 NAD 0.002376 0.41882 2.84974
60 5JWC FAD 0.0001539 0.40928 2.84974
61 1M2W NAD 0.00376 0.40743 2.84974
62 2BD0 NAP 0.0004729 0.40693 2.86885
63 3B20 NAD 0.0001308 0.46285 2.94985
64 4GKV NAD 0.0000008132 0.48315 2.97619
65 1ZEM NAD 0.00001062 0.4913 3.05344
66 1VM6 NAD 0.0001316 0.45648 3.07018
67 1NFQ NAI 0.0003002 0.41198 3.07692
68 5UAV TFB 0.00001745 0.43181 3.10559
69 5UAV NDP 0.00001745 0.43181 3.10559
70 1P77 ATR 0.000003682 0.6079 3.10881
71 4X1B MLI 0.006635 0.45063 3.10881
72 4XQC NAD 0.000001249 0.43292 3.10881
73 4XQC 13D 0.000001474 0.4271 3.10881
74 4U7W NDP 0.0008505 0.41535 3.10881
75 3VSE SAH 0.0143 0.41252 3.10881
76 4RDH AMP 0.0002181 0.48527 3.125
77 4RDI ATP 0.0004339 0.46209 3.125
78 1E3I CXF 0.000005458 0.44748 3.19149
79 3VYW SAM 0.004833 0.40913 3.24675
80 4D79 ATP 0.00009113 0.49201 3.26087
81 4L8V NAP 0.000006756 0.47638 3.2641
82 1L7N ALF 0.02691 0.40349 3.31754
83 1WDK NAD 0.00004666 0.48518 3.36788
84 4PIV NDP 0.000573 0.40742 3.36788
85 3KLJ FAD 0.0003359 0.40478 3.37662
86 3GFB NAD 0.000000512 0.53133 3.42857
87 1EZ4 NAD 0.0000003518 0.54661 3.45912
88 2AHR NAP 0.0003639 0.4146 3.4749
89 5AYV NAP 0.000006732 0.51946 3.55987
90 5AYV KPL 0.00001835 0.43511 3.55987
91 1O5I NAD 0.003133 0.42057 3.61446
92 1DJN ADP 0.0001103 0.46994 3.62694
93 3L9W AMP 0.00003518 0.44646 3.62694
94 3L9W GSH 0.0001413 0.43727 3.62694
95 1ZMD NAI 0.0005218 0.43261 3.62694
96 3DTU DXC 0.01618 0.41574 3.62694
97 2X6T NAP 0.0006092 0.41017 3.64146
98 5T9E NAP 0.00003223 0.47321 3.69004
99 3C1O NAP 0.001163 0.42487 3.73832
100 4YCA NDP 0.00006095 0.46348 3.7415
101 1NVM NAD 0.00001812 0.45674 3.76812
102 3A4V NAD 0.0002402 0.40388 3.78549
103 3A4V PYR 0.0002402 0.40388 3.78549
104 2GZ3 NAP 0.0001361 0.41581 3.82514
105 3IT7 TLA 0.03722 0.40685 3.84615
106 3L4S NAD 0.00006707 0.42961 3.86905
107 3L4S 3PG 0.00007306 0.42325 3.86905
108 2FKA BEF 0.02293 0.41235 3.87597
109 4OOE NDP 0.001069 0.4155 3.88601
110 5DNK SAH 0.02299 0.40224 3.88601
111 3FGZ BEF 0.01574 0.42287 3.90625
112 1CDO NAD 0.00004064 0.46981 4.01069
113 2XYQ SAH 0.006879 0.40905 4.09836
114 3ABI NAD 0.0000002002 0.53038 4.10959
115 1ZH8 NAP 0.0002488 0.43354 4.11765
116 1MV8 NAD 0.0000021 0.51685 4.14508
117 1MUU NAD 0.000004698 0.51185 4.14508
118 4HXY NDP 0.00007527 0.43739 4.14508
119 1Q19 SSC 0.009257 0.43292 4.14508
120 1LCF OXL 0.01581 0.42067 4.14508
121 5E4R NAP 0.000529 0.41675 4.14508
122 1GUZ NAD 0.000003356 0.4966 4.19355
123 3VPH NAD 0.000001506 0.48168 4.19355
124 3VPH OXM 0.000001606 0.46933 4.19355
125 1YS4 NAP 0.0002287 0.46109 4.23729
126 1XCL SAH 0.0004678 0.40497 4.25532
127 3OID NDP 0.0005739 0.40065 4.26357
128 3WLE NAD 0.00001227 0.438 4.39883
129 3OA2 NAD 0.00001919 0.4658 4.40252
130 2RGJ FAD 0.0003608 0.40247 4.40415
131 5H6S HDH 0.03792 0.40024 4.40415
132 5CAE COA 0.00001511 0.50036 4.47284
133 5CAE SIN 0.00002622 0.44239 4.47284
134 5X20 NAD 0.00001232 0.4956 4.48718
135 1VL8 NAP 0.0002027 0.41538 4.49438
136 1CER NAD 0.00000455 0.50356 4.53172
137 1ZQ9 SAM 0.004798 0.41598 4.5614
138 2YVJ NAI 0.0004438 0.46166 4.58716
139 4JBI NDP 0.001458 0.41695 4.59459
140 2HNK SAH 0.006717 0.40305 4.60251
141 1D1T NAD 0.0000009128 0.49384 4.66321
142 1PJS NAD 0.00001181 0.46855 4.66321
143 1U8X NAD 0.0001297 0.45028 4.66321
144 5E70 RCD 0.01325 0.41276 4.66321
145 4XDZ NDP 0.0005017 0.43363 4.66472
146 2DT5 NAD 0.0000003517 0.5296 4.73934
147 1LDN NAD 0.000001495 0.49411 4.74684
148 1NYT NAP 0.00006496 0.46944 4.79705
149 1ZBQ NAD 0.0004764 0.40637 4.89297
150 2HYR BGC GLC 0.0156 0.43504 4.91803
151 2GUD MAN 0.01574 0.43479 4.91803
152 2NU5 NAG 0.01648 0.43342 4.91803
153 2GUC MAN 0.01734 0.43152 4.91803
154 2NUO BGC 0.01638 0.42993 4.91803
155 2HYQ MAN MAN 0.03052 0.41808 4.91803
156 3IHG FAD 0.0009855 0.40313 4.92228
157 3JV7 NAD 0.00002021 0.4623 4.92754
158 1P1C SAH 0.001725 0.42124 5.02513
159 2C29 NAP 0.001059 0.40639 5.04451
160 2Q1W NAD 0.00005893 0.42777 5.1051
161 1KEV NDP 0.00002363 0.43788 5.12821
162 5H81 NAP 0.000007272 0.52334 5.18135
163 2YY7 NAD 0.0001479 0.42751 5.18135
164 5MSO NAP 0.00217 0.40445 5.18135
165 1NPD NAD 0.0003525 0.44562 5.20833
166 5VKT NAP 0.0003821 0.41929 5.24862
167 1YJQ NAP 0.00002262 0.44357 5.28053
168 5JE8 NAD 0.0000008626 0.54075 5.29801
169 1EBF NAD 0.000008507 0.51034 5.30726
170 3A06 NDP 0.0003041 0.40326 5.31915
171 5FI3 NAP 0.00008144 0.44344 5.32213
172 1U7T NAD 0.0003879 0.42637 5.36398
173 2IDO TMP 0.03644 0.40107 5.37634
174 5BSH PRO 0.0005582 0.40011 5.41516
175 1E5Q NDP 0.000006012 0.48714 5.44041
176 5ITV NAI 0.00004061 0.44495 5.4902
177 2DKN NAI 0.0002597 0.42919 5.4902
178 1HYH NAD 0.0000002954 0.51679 5.50162
179 2A92 NAI 0.000002639 0.48171 5.60748
180 2VYN NAD 0.000061 0.44978 5.68862
181 2CDU ADP 0.00001559 0.53182 5.69948
182 1J78 OLA 0.03012 0.41548 5.69948
183 1LSS NAD 0.0000214 0.50893 5.71429
184 4JK3 NAD 0.000001055 0.5291 5.79151
185 4J4H 1J1 0.000007108 0.40595 5.79151
186 4J4H NAI 0.000007108 0.40595 5.79151
187 1NVT NAP 0.0001962 0.4558 5.92335
188 3QV1 NAD 0.0000152 0.49187 5.93472
189 4J1Q NDP 0.0002414 0.4575 5.95855
190 1GY8 NAD 0.0002884 0.41711 5.95855
191 3TWO NDP 0.000005962 0.4558 6.03448
192 3TTM PUT 0.02486 0.40069 6.06936
193 1EJ0 SAM 0.0004271 0.46239 6.11111
194 3H8V ATP 0.000006096 0.54386 6.16438
195 3AFN NAP 0.0005057 0.40334 6.20155
196 3MJE NDP 0.0001896 0.42849 6.21762
197 2Y6Q FAD 0.000116 0.42228 6.21762
198 3JQA NAP 0.0003169 0.43056 6.25
199 3BMO NAP 0.0002874 0.427 6.25
200 3JQG NAP 0.0003984 0.42694 6.25
201 4CMI NAP 0.0002905 0.42677 6.25
202 4CM8 NAP 0.0002947 0.42665 6.25
203 4CLO NAP 0.0004392 0.42593 6.25
204 4CME NAP 0.0003489 0.42472 6.25
205 3JQB NAP 0.0004749 0.42456 6.25
206 4CLR NAP 0.0003459 0.42411 6.25
207 4CM4 NAP 0.0003535 0.42398 6.25
208 3JQF NAP 0.0002694 0.42329 6.25
209 4CM9 NAP 0.0002986 0.42118 6.25
210 3JQ8 NAP 0.0003162 0.42081 6.25
211 3BMQ NAP 0.0003206 0.42077 6.25
212 4IF4 BEF 0.01464 0.41952 6.25
213 3BMN NAP 0.0004234 0.41674 6.25
214 3JQ9 NAP 0.0004783 0.41507 6.25
215 3JQ7 NAP 0.001481 0.40598 6.25
216 5KKA 6V0 0.000001148 0.49231 6.41026
217 5L95 AMP 0.000006053 0.53796 6.45161
218 1QMG APX 0.001559 0.42304 6.47668
219 3O8M BGC 0.01474 0.41187 6.47668
220 3O8M GLC 0.01474 0.41187 6.47668
221 3NUG NAD 0.0008925 0.40183 6.47668
222 1BXK NAD 0.0002001 0.4313 6.47887
223 4J36 FAD 0.00008094 0.42415 6.50602
224 1F8G NAD 0.0001336 0.47079 6.51042
225 2OOR NAD 0.0001488 0.46886 6.51042
226 1L7E NAI 0.000296 0.44865 6.51042
227 1W8D NAP 0.0001316 0.46275 6.62252
228 1W73 NAP 0.0001391 0.46178 6.62252
229 3GGO ENO 0.000001069 0.44073 6.6879
230 3GGO NAI 0.000001069 0.44073 6.6879
231 3OJO NAD 0.000002591 0.53637 6.73575
232 5AHO TLA 0.009253 0.42146 6.73575
233 1VBJ CIT 0.02964 0.4204 6.76157
234 1YQD NAP 0.00006745 0.4323 6.8306
235 2GLX NDP 0.0009695 0.42803 6.92771
236 1Y8Q ATP 0.0002879 0.44914 6.99482
237 1L5Y BEF 0.007508 0.43719 7.09677
238 3LU1 NAD 0.0003025 0.41772 7.14286
239 5LOG SAH 0.006877 0.40576 7.29614
240 1BW9 NAD 0.0000009911 0.55931 7.30337
241 1BXG NAD 0.0000007462 0.53352 7.30337
242 1LLU NAD 0.000001872 0.47187 7.30994
243 1C1X NAD 0.000001074 0.52818 7.32394
244 2G5C NAD 0.000002665 0.4908 7.47331
245 2QRK AMP 0.00004528 0.41823 7.51295
246 3CIF NAD 0.00001524 0.47004 7.52089
247 3CIF G3H 0.0001071 0.40885 7.52089
248 1W6U NAP 0.0003098 0.44786 7.61589
249 1CF2 NAP 0.00002266 0.49734 7.71513
250 3EGI ADP 0.01466 0.42059 7.76699
251 1PL6 NAD 0.0000005477 0.57641 7.86517
252 1PL6 572 0.000003457 0.47517 7.86517
253 3TTN SPD 0.02702 0.40738 7.94118
254 2CVQ NDP 0.00004413 0.45754 7.95107
255 4DPL NAP 0.0001043 0.44044 8.07799
256 1F06 NDP 0.0001654 0.41261 8.125
257 1F06 2NP 0.0001654 0.41261 8.125
258 2CVZ NDP 0.00001245 0.48863 8.3045
259 4ZRN NAD 0.0002279 0.40604 8.33333
260 4A0S NAP 0.0007137 0.40773 8.54922
261 3V1Y NAD 0.0000124 0.48744 8.60534
262 1PR9 NAP 0.000592 0.40015 8.60656
263 1H5Q NAP 0.0004708 0.41082 8.67924
264 1OMO NAD 0.000003079 0.528 8.69565
265 2HK9 ATR 0.000009187 0.57038 8.72727
266 2HK9 NAP 0.00001543 0.48555 8.72727
267 1RKX NAD 0.0009289 0.40068 8.96359
268 1GEG NAD 0.0002059 0.42791 8.98438
269 5N2I NAP 0.00003285 0.50105 9.05172
270 3ZOA ACR 0.02048 0.40872 9.06736
271 4II2 ATP 0.0004322 0.45361 9.20245
272 2FR1 NDP 0.0001568 0.42267 9.25926
273 2Q0L NAP 0.001796 0.44307 9.32476
274 5D4V SAH 0.0005135 0.44649 9.32836
275 1WP4 NDP 0.000002541 0.5071 9.34256
276 2FZW NAD 0.00001327 0.41033 9.38338
277 1X7D NAD 0.00001009 0.47774 9.42857
278 1X7D ORN 0.0000189 0.42552 9.42857
279 1U1I NAD 0.00002116 0.43987 9.58549
280 1LES GLC FRU 0.003733 0.45826 9.61539
281 4D3F NAP 0.000001562 0.5511 9.67742
282 2PV7 NAD 0.000009031 0.48597 9.73154
283 4XDY NAI 0.0001402 0.44982 10.0592
284 3H4V NAP 0.000318 0.42126 10.0694
285 1OFS SUC 0.009769 0.43465 10.4167
286 4NBT NAD 0.000581 0.41562 10.4167
287 1FWV SGA MAG FUC 0.001434 0.47628 10.4478
288 4JJF FE9 0.0006731 0.418 10.4651
289 4JJF N2I 0.0007227 0.40762 10.4651
290 5TQZ GLC 0.01185 0.42671 10.6667
291 3NGL NAP 0.006613 0.40334 10.8696
292 1LOB MMA 0.02994 0.40026 11.0497
293 1E3W NAD 0.0001662 0.42988 11.1111
294 1E6W NAD 0.0004303 0.4146 11.1538
295 2VT3 ATP 0.0000000826 0.6614 11.1628
296 2B4R NAD 0.00002553 0.45014 11.3043
297 2B4R AES 0.00007697 0.43884 11.3043
298 1KYQ NAD 0.000005059 0.55385 11.6788
299 1LUA NAP 0.0003636 0.45679 11.8467
300 1Z82 NDP 0.0002944 0.43089 11.9403
301 2F1K NAP 0.000004163 0.50566 12.1864
302 1X14 NAD 0.0001493 0.48757 12.6943
303 4QED NAP 0.001299 0.401 12.9032
304 1O94 ADP 0.0001461 0.46093 13.2576
305 2YYY NAP 0.000415 0.42135 13.7026
306 5DOZ NDP 0.0007296 0.40899 13.9053
307 5T9F NAP 0.00001518 0.43574 14.0221
308 5T9F TYR 0.00001051 0.4351 14.0221
309 3WV8 ATP 0.00001237 0.52453 14.2202
310 4MDH NAD 0.00005568 0.45858 14.3713
311 5MDH NAD 0.00005269 0.45915 14.4144
312 3QWI NAP 0.0003681 0.41189 14.4444
313 2VHW NAI 0.0000003628 0.48323 15.1194
314 1WOQ BGC 0.02495 0.40047 15.544
315 2EV9 SKM 0.00002241 0.45087 15.5894
316 2EV9 NAP 0.00002241 0.45087 15.5894
317 1AE1 NAP 0.0002449 0.40907 16.1172
318 1V8B NAD 0.000002131 0.46137 16.3212
319 4CJX NAP 0.0009576 0.42303 17.5549
320 2DC1 NAD 0.0000006612 0.52764 19.0678
321 3NJ4 AFX 0.00003558 0.55937 20
322 3NJ4 NAD 0.00003558 0.55937 20
323 4XZ3 COA 0.0009102 0.43257 20.4348
324 1I36 NAP 0.00003841 0.4933 20.8333
325 3ORF NAD 0.00008209 0.44528 23.506
326 2BOS GLA GAL GLC NBU 0.01982 0.40274 23.5294
327 4CQM NAP 0.0002639 0.42393 23.7705
328 4XYB NDP 0.00000000003571 0.61812 26.087
329 3OND NAD 0.000005638 0.40578 26.6839
330 3OND ADN 0.000005638 0.40578 26.6839
331 5DN9 NAD 0.000000000006648 0.65048 28.5714
332 2O4C NAD 0.00000000002232 0.65406 29.4737
333 2NAD NAD 0.00000000004901 0.60539 33.1606
334 1SC6 NAD 0.00000002529 0.54548 33.1606
335 2DBZ NAP 0.000000000004979 0.70105 36.8263
336 2GCG NDP 0.000000002056 0.61146 43.0303
337 2VOH CIT 0.01727 0.43432 46.1538
338 3KB6 NAD 0.00000000000005329 0.78404 46.7066
339 5OFW 9TW 0.000001268 0.64575 47.9821
Pocket No.: 2; Query (leader) PDB : 4ZGS; Ligand: NAD; 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: 4zgs.bio1) has 24 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 4ZGS; Ligand: NAD; 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: 4zgs.bio1) has 25 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 4ZGS; Ligand: NAD; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 4) in the query (biounit: 4zgs.bio1) has 25 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 5; Query (leader) PDB : 4ZGS; Ligand: NAD; 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: 4zgs.bio2) has 25 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 6; Query (leader) PDB : 4ZGS; Ligand: NAD; Similar sites found: 20
This union binding pocket(no: 6) in the query (biounit: 4zgs.bio2) has 27 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4YEE 4CQ 0.03096 0.40489 None
2 2ZWS PLM 0.01236 0.41313 1.29534
3 1OFL NGK GCD 0.02735 0.40839 1.29534
4 2BES RES 0.02035 0.40256 2.32558
5 3GRU AMP 0.005522 0.40215 3.05085
6 4KQW NAP 0.0003057 0.40736 3.14286
7 4HNN LYS 0.02468 0.41058 3.75723
8 5KQA GSH 0.03137 0.40048 3.78788
9 5VLQ ANP 0.008994 0.43913 4.14508
10 1JLV GSH 0.03553 0.40172 4.78469
11 2GUD BMA 0.034 0.41481 4.91803
12 2CJZ PTR 0.02383 0.40158 4.91803
13 2XOC ADE 0.02611 0.40564 6.51341
14 5TCI MLI 0.02864 0.4053 8.29016
15 1I1Q TRP 0.03018 0.40146 8.33333
16 2RI1 GLP 0.03876 0.4003 9.3617
17 1A99 PUT 0.01611 0.42137 9.88372
18 3EF0 ALF 0.01572 0.41742 11.828
19 4K55 H6P 0.0301 0.40694 14.5161
20 3LQV ADE 0.02468 0.40936 15.3846
Pocket No.: 7; Query (leader) PDB : 4ZGS; Ligand: NAD; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 7) in the query (biounit: 4zgs.bio2) has 26 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 8; Query (leader) PDB : 4ZGS; Ligand: NAD; 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: 4zgs.bio2) has 24 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
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