Receptor
PDB id Resolution Class Description Source Keywords
3AB1 2.39 Å EC: 1.18.1.2 CRYSTAL STRUCTURE OF FERREDOXIN NADP+ OXIDOREDUCTASE CHLOROBACULUM TEPIDUM OXIDOREDUCTASE ELECTRON TRANSPORT FAD FLAVOPROTEIN NADP
Ref.: ASYMMETRIC DIMERIC STRUCTURE OF FERREDOXIN-NAD(P)+ OXIDOREDUCTASE FROM THE GREEN SULFUR BACTERIUM CHLO TEPIDUM: IMPLICATIONS FOR BINDING FERREDOXIN AND NA J.MOL.BIOL. V. 401 403 2010
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
FAD A:361;
B:361;
Valid;
Valid;
none;
none;
submit data
785.55 C27 H33 N9 O15 P2 Cc1cc...
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90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3AB1 2.39 Å EC: 1.18.1.2 CRYSTAL STRUCTURE OF FERREDOXIN NADP+ OXIDOREDUCTASE CHLOROBACULUM TEPIDUM OXIDOREDUCTASE ELECTRON TRANSPORT FAD FLAVOPROTEIN NADP
Ref.: ASYMMETRIC DIMERIC STRUCTURE OF FERREDOXIN-NAD(P)+ OXIDOREDUCTASE FROM THE GREEN SULFUR BACTERIUM CHLO TEPIDUM: IMPLICATIONS FOR BINDING FERREDOXIN AND NA J.MOL.BIOL. V. 401 403 2010
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 22 families.
1 3AB1 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 15 families.
1 3AB1 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
50% Homology Family (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 8 families.
1 3LZX Kd = 14 uM NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
2 3LZW Kd = 14 uM NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
3 3AB1 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: FAD; Similar ligands found: 119
No: Ligand ECFP6 Tc MDL keys Tc
1 FAS 1 1
2 FAD 1 1
3 FAY 0.859259 0.9875
4 RFL 0.852941 0.963855
5 6FA 0.794118 0.987654
6 DAL FAD PER 0.772414 0.951807
7 FAE 0.751773 0.987654
8 SFD 0.651007 0.860215
9 FDA 0.641892 0.906977
10 FNK 0.602564 0.876405
11 62F 0.572327 0.939024
12 F2N 0.566265 0.886364
13 FMN 0.543307 0.876543
14 FA9 0.526316 0.939759
15 6YU 0.516304 0.860215
16 CNV FAD 0.511905 0.908046
17 P6G FDA 0.511628 0.908046
18 FAD NBT 0.508876 0.83871
19 A2D 0.504065 0.875
20 P5F 0.491329 0.941176
21 FAD CNX 0.488506 0.8125
22 APR 0.488372 0.851852
23 AR6 0.488372 0.851852
24 AGS 0.484615 0.811765
25 SAP 0.484615 0.811765
26 M33 0.484375 0.864198
27 BA3 0.484127 0.875
28 FAD NBA 0.480663 0.802083
29 ATP 0.48062 0.851852
30 B4P 0.480315 0.875
31 ADP 0.480315 0.851852
32 AP5 0.480315 0.875
33 ANP 0.477273 0.831325
34 AQP 0.476923 0.851852
35 5FA 0.476923 0.851852
36 48N 0.469388 0.902439
37 OAD 0.467626 0.876543
38 GTA 0.465753 0.892857
39 AN2 0.465116 0.841463
40 AD9 0.462121 0.831325
41 3OD 0.460993 0.876543
42 RBF 0.460938 0.790123
43 FB0 0.460606 0.835165
44 139 0.460526 0.858824
45 AP0 0.46 0.835294
46 A22 0.459854 0.864198
47 ACP 0.458015 0.853659
48 8QN 0.456522 0.864198
49 PRX 0.454545 0.831325
50 A1R 0.453237 0.86747
51 G3A 0.452055 0.902439
52 T5A 0.45098 0.872093
53 G5P 0.44898 0.902439
54 ATF 0.448529 0.821429
55 50T 0.44697 0.819277
56 ACQ 0.444444 0.853659
57 PAJ 0.442857 0.847059
58 ADQ 0.442857 0.853659
59 5AL 0.441176 0.864198
60 ADX 0.439394 0.775281
61 CA0 0.439394 0.853659
62 A4P 0.437909 0.831461
63 25L 0.4375 0.864198
64 P33 FDA 0.436464 0.817204
65 5SV 0.435714 0.793103
66 TXE 0.434211 0.890244
67 OMR 0.434211 0.818182
68 ABM 0.434109 0.829268
69 A 0.433071 0.82716
70 AMP 0.433071 0.82716
71 4AD 0.432624 0.855422
72 ADJ 0.432258 0.818182
73 BIS 0.430556 0.802326
74 SRA 0.429688 0.788235
75 AFH 0.42953 0.825581
76 TXD 0.427632 0.890244
77 NXX 0.427632 0.865854
78 UP5 0.427632 0.878049
79 DND 0.427632 0.865854
80 6V0 0.427632 0.857143
81 SRP 0.42446 0.843373
82 PR8 0.423611 0.837209
83 TAT 0.423358 0.821429
84 AMO 0.422535 0.865854
85 PTJ 0.42069 0.835294
86 FYA 0.42069 0.864198
87 TXA 0.42069 0.865854
88 CNA 0.420382 0.865854
89 00A 0.41958 0.823529
90 AHX 0.41958 0.835294
91 MAP 0.41844 0.811765
92 NAI 0.418301 0.845238
93 AU1 0.41791 0.831325
94 AP2 0.416667 0.843373
95 A12 0.416667 0.843373
96 25A 0.415493 0.851852
97 AMP MG 0.415385 0.785714
98 COD 0.415094 0.842697
99 ADP BEF 0.414815 0.77907
100 BEF ADP 0.414815 0.77907
101 4TC 0.412903 0.879518
102 APC 0.411765 0.843373
103 NB8 0.410959 0.835294
104 ME8 0.410959 0.806818
105 1ZZ 0.410959 0.806818
106 4UW 0.409091 0.825581
107 NAX 0.409091 0.837209
108 RBY 0.408759 0.843373
109 ADV 0.408759 0.843373
110 ADP MG 0.407407 0.797619
111 P1H 0.405882 0.818182
112 OOB 0.405594 0.864198
113 A A 0.40411 0.829268
114 LAD 0.40411 0.825581
115 UPA 0.403846 0.86747
116 4UU 0.401316 0.833333
117 A3D 0.401235 0.876543
118 DLL 0.4 0.864198
119 XAH 0.4 0.806818
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3AB1; Ligand: FAD; Similar sites found: 526
This union binding pocket(no: 1) in the query (biounit: 3ab1.bio1) has 41 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1WAP TRP 0.03908 0.40036 None
2 3JV7 NAD 0.0004497 0.44629 0.869565
3 1LDM NAD 0.0001833 0.46158 1.21581
4 4ZCC NAI 0.0000001692 0.48668 1.4881
5 4ZCC FAD 0.0000001692 0.48668 1.4881
6 4IV9 FAD 0.00000006606 0.54974 1.66667
7 1RYI FAD 0.0000003058 0.5288 1.66667
8 3TLJ SAH 0.006258 0.41678 1.66667
9 2OAT PFM 0.01902 0.40959 1.66667
10 5F8F SFG 0.02632 0.40583 1.66667
11 4MDH NAD 0.002853 0.42001 1.79641
12 4E5N NAD 0.0004026 0.40004 1.81818
13 4AT0 FAD 0.0000003882 0.5339 1.94444
14 1DLJ NAI 0.00006571 0.45862 1.94444
15 1GQ2 NAP 0.0004132 0.45083 1.94444
16 2Q1S NAI 0.0000923 0.44694 1.94444
17 1DLJ UGA 0.0001911 0.4424 1.94444
18 1XDS SAM 0.02565 0.4096 1.94444
19 3GFB NAD 0.0002276 0.46453 2
20 3ZNN FAD 0.0000008527 0.53169 2.01729
21 3ZNN 4WL 0.0000008527 0.53169 2.01729
22 2VDV SAM 0.001022 0.47951 2.03252
23 4YCA NDP 0.00009079 0.48447 2.04082
24 2BKX F6R 0.005478 0.44318 2.06612
25 1CF2 NAP 0.00005785 0.4113 2.07715
26 2FK8 SAM 0.001273 0.45392 2.20126
27 5EB4 FAD 0.0000003256 0.5263 2.22222
28 3GDN HBX 0.00000111 0.52181 2.22222
29 3GDN FAD 0.000000582 0.5208 2.22222
30 1Z45 NAD 0.000502 0.44442 2.22222
31 1QMG APX 0.004949 0.42121 2.22222
32 4UZI IMD 0.03834 0.41388 2.22222
33 5TH5 MET 0.04489 0.41113 2.28137
34 5M67 3D1 0.0003227 0.43348 2.29645
35 5M67 ADE 0.0003299 0.43314 2.29645
36 5M67 NAD 0.0003527 0.43213 2.29645
37 1UDB NAD 0.002539 0.40394 2.36686
38 3U31 NAD 0.002836 0.43492 2.41379
39 5GZ6 NDP 0.0007025 0.46555 2.45399
40 5GZ6 7C3 0.001225 0.44756 2.45399
41 3E1T FAD 0.00000000164 0.60956 2.5
42 4RPL FAD 0.0000005179 0.54591 2.5
43 4RPL 3UC 0.000001244 0.53504 2.5
44 5FA5 MTA 0.0004852 0.49057 2.5
45 5DN9 NAD 0.0005736 0.43367 2.5
46 1OFL NGK GCD 0.03641 0.41538 2.5
47 5VKT NAP 0.006473 0.4008 2.5
48 1A5Z NAD 0.000004618 0.42066 2.50784
49 3QJ4 FAD 0.0000001846 0.54261 2.63158
50 5JE8 NAD 0.0001844 0.47547 2.64901
51 3V1Y NAD 0.0000233 0.41903 2.67062
52 3AXB FAD 0.00000005169 0.56625 2.67857
53 3AXB PRO 0.0000001086 0.53058 2.67857
54 1DSS NAD 0.00001189 0.42341 2.7027
55 1I0Z NAI 0.0001121 0.4098 2.7027
56 1HDG NAD 0.0002426 0.47048 2.71084
57 1CER NAD 0.00008512 0.48562 2.71903
58 1NAA ABL 0.0000006741 0.53185 2.77778
59 1NAA 6FA 0.0000003128 0.53149 2.77778
60 4Z24 FAD 0.0000003813 0.51314 2.77778
61 2RGO FAD 0.0000004282 0.51159 2.77778
62 5H81 NAP 0.001434 0.44801 2.77778
63 1KOL NAD 0.0003481 0.41309 2.77778
64 1KEW NAD 0.002371 0.40499 2.77778
65 2CDC XYP 0.005622 0.4004 2.77778
66 3OJO NAD 0.000003957 0.42293 2.78422
67 2RGH FAD 0.0000005841 0.51772 2.8021
68 1EZ4 NAD 0.00007475 0.48794 2.83019
69 1DL5 SAH 0.001709 0.43193 2.83912
70 4ZRN NAD 0.0002214 0.44627 2.88462
71 5AYV KPL 0.0002809 0.41309 2.91262
72 4YMH SAH 0.001184 0.45534 2.91667
73 3L4S NAD 0.0004157 0.40018 2.97619
74 3L4S 3PG 0.0005102 0.40018 2.97619
75 4ZNO SUC 0.03428 0.42457 2.98507
76 2YY8 MTA 0.0245 0.41405 2.98507
77 1DXY NAD 0.00009464 0.40065 3.003
78 4NEC SAH 0.02866 0.404 3.0303
79 5JWC FAD 0.000000006477 0.60822 3.05556
80 5TUF FAD 0.00000003576 0.59631 3.05556
81 3T31 FAD 0.00000002479 0.58382 3.05556
82 3T31 DCQ 0.00000002933 0.58382 3.05556
83 2GMH FAD 0.00000002944 0.55528 3.05556
84 4DSG UDP 0.000001117 0.53075 3.05556
85 5UAO FAD 0.0000002625 0.52229 3.05556
86 4XFR CIT 0.003131 0.48048 3.05556
87 1ELI PYC 0.0000112 0.46829 3.05556
88 5TUF TDC 0.0000002317 0.45536 3.05556
89 4DSG FAD 0.000001117 0.43625 3.05556
90 3LU1 NAD 0.000933 0.43385 3.05556
91 2GMM MAN MAN 0.02868 0.42565 3.05556
92 2PHW MAN MAN 0.04602 0.41049 3.05556
93 4XYB NDP 0.002079 0.41038 3.05556
94 2PHR MAN MAN 0.04686 0.41005 3.05556
95 4J4H 1J1 0.001097 0.41309 3.0888
96 4J4H NAI 0.001097 0.41309 3.0888
97 4JK3 NAD 0.00007523 0.40451 3.0888
98 5F6U 5VK 0.02784 0.42425 3.18471
99 4NBU NAI 0.003482 0.40896 3.2
100 5KKA 6V0 0.000944 0.42818 3.20513
101 3WV8 ATP 0.000003319 0.42372 3.21101
102 3HAD NAD 0.001382 0.41145 3.24675
103 2FJK 13P 0.03805 0.40758 3.27869
104 1V6A TRE 0.0004085 0.52566 3.31325
105 5TUK FAD 0.0000001546 0.5929 3.33333
106 1VQW FAD 0.000000004158 0.5572 3.33333
107 2GVC FAD 0.000000005094 0.55444 3.33333
108 2GV8 FAD 0.000000008452 0.55267 3.33333
109 2R4J FAD 0.000001015 0.52439 3.33333
110 2R4J 13P 0.000001015 0.52439 3.33333
111 5TCI MLI 0.02282 0.43097 3.33333
112 1E3I CXF 0.0004624 0.42927 3.33333
113 2BH9 NAP 0.01172 0.4231 3.33333
114 3FPF TNA 0.0007753 0.41428 3.3557
115 3FPF MTA 0.0007753 0.40964 3.3557
116 5ULP KB1 0.006306 0.41383 3.35821
117 1JQ3 AAT 0.000128 0.45807 3.37838
118 5MGZ SAH 0.01172 0.41337 3.38983
119 4FWE FAD 0.00000002851 0.56711 3.39196
120 3BBH SFG 0.01637 0.41272 3.41463
121 5EOW FAD 0.000000007709 0.61071 3.45679
122 5THY SAH 0.01231 0.40946 3.45679
123 2B4R NAD 0.00006531 0.4213 3.47826
124 2B4R AES 0.0001397 0.4089 3.47826
125 1G55 SAH 0.009879 0.4168 3.49854
126 4NAE 1GP 0.03315 0.41883 3.55556
127 3VYW SAM 0.001663 0.44869 3.57143
128 1RPN NDP 0.004512 0.40232 3.58209
129 3AYI HCI 0.0000001074 0.56001 3.6061
130 3AYI FAD 0.000000108 0.55863 3.6061
131 1COY FAD 0.0000004571 0.5159 3.61111
132 3ABI NAD 0.0002068 0.45953 3.61111
133 1COY AND 0.000002645 0.4374 3.61111
134 4DMG SAM 0.01554 0.42419 3.61111
135 1VKO NAD 0.001467 0.42089 3.61111
136 3OTH TYD 0.03333 0.40076 3.61111
137 1WDK NAD 0.00003815 0.40056 3.61111
138 3HVJ 705 0.0008289 0.40327 3.61991
139 3A27 SAM 0.0009244 0.46816 3.67647
140 1NML CIT 0.04737 0.40979 3.68098
141 2O4C NAD 0.0001424 0.41089 3.68421
142 4R6W PC 0.002505 0.40498 3.87597
143 4TXI FAD 0.000000001761 0.64603 3.88889
144 5BUK FAD 0.000000002408 0.60559 3.88889
145 5EVY FAD 0.000001846 0.57002 3.88889
146 2BRY FAD 0.000000002154 0.56393 3.88889
147 4MIG G3F 0.0000001692 0.54781 3.88889
148 1BW9 NAD 0.00003033 0.52202 3.93258
149 1BXG NAD 0.00003731 0.4125 3.93258
150 1C1X NAD 0.00002304 0.509 3.94366
151 1JNR FAD 0.00000003706 0.59693 4
152 4K5S FAD 0.00000000009617 0.60605 4.10448
153 4K5S PM0 0.000000003682 0.60574 4.10448
154 1R6D NAD 0.0008946 0.42159 4.1543
155 1R6D DAU 0.001267 0.41541 4.1543
156 1YKJ FAD 0.0000000246 0.59265 4.16667
157 2E5V FAD 0.00000001848 0.57355 4.16667
158 3IHG FAD 0.00000001678 0.5167 4.16667
159 1YKJ PHB 0.0000000246 0.4699 4.16667
160 3GF4 FAD 0.0000006368 0.46141 4.16667
161 3GF4 UPG 0.0000003641 0.45622 4.16667
162 3VPH OXM 0.0000442 0.43852 4.19355
163 3VPH NAD 0.00007036 0.42586 4.19355
164 9LDB NAD 0.00003331 0.42973 4.21687
165 9LDT NAD 0.00003375 0.42926 4.21687
166 2QHV OC9 0.03822 0.41111 4.28571
167 1GEG NAD 0.005535 0.40348 4.29688
168 3G2O SAM 0.00305 0.44389 4.34783
169 2PT9 2MH 0.0003463 0.40925 4.36137
170 2PT9 S4M 0.00009922 0.40247 4.36137
171 2QA1 FAD 0.000000001079 0.6365 4.4
172 1LDN NAD 0.0000324 0.42954 4.43038
173 2NVK FAD 0.000000002934 0.59734 4.44444
174 4EIP K2C 0.00000004323 0.56554 4.44444
175 2RGJ FAD 0.000000004944 0.55372 4.44444
176 2DKH FAD 0.000000006399 0.5494 4.44444
177 4C3Y FAD 0.0000001857 0.53616 4.44444
178 1I8T FAD 0.0000001541 0.53365 4.44444
179 2DKH 3HB 0.0000001523 0.53337 4.44444
180 4C3Y ANB 0.0000007496 0.52265 4.44444
181 4EIP FAD 0.00000004323 0.52087 4.44444
182 1PZG A3D 0.001171 0.41254 4.44444
183 3WMX NAD 0.0009879 0.44174 4.46927
184 5OFW 9TW 0.02424 0.42843 4.4843
185 2F5X ASP 0.04524 0.41243 4.48718
186 3CMC NAD 0.003416 0.40893 4.49102
187 1FS5 TLA 0.01079 0.42485 4.51128
188 1SB8 UD2 0.001097 0.41761 4.54545
189 1SB8 NAD 0.0009419 0.41633 4.54545
190 5N53 8NB 0.003948 0.47115 4.61538
191 2A92 NAI 0.000256 0.4072 4.6729
192 4X9M FAD 0.00000008771 0.54557 4.72222
193 1Y8Q ATP 0.000006242 0.54198 4.72222
194 2X3N FAD 0.0000001358 0.52663 4.72222
195 3HDY FAD 0.00000262 0.51846 4.72222
196 3HDY FDA 0.000002719 0.51787 4.72222
197 3HDY GDU 0.000002896 0.51787 4.72222
198 3Q9T FAY 0.000003715 0.4842 4.72222
199 5MZI FAD 0.00000005083 0.4711 4.72222
200 5MZI FYK 0.00000005486 0.46666 4.72222
201 1D1T NAD 0.0006983 0.43879 4.72222
202 3L9W AMP 0.00004121 0.42484 4.72222
203 3L9W GSH 0.00008911 0.40827 4.72222
204 5O4J 9KH 0.0004346 0.40762 4.72222
205 5O4J SAH 0.0004346 0.40762 4.72222
206 5O4J PJL 0.0004643 0.40412 4.72222
207 4HXY NDP 0.0003626 0.40039 4.72222
208 4DPL NAP 0.006669 0.40029 4.73538
209 1RM4 NDP 0.0001607 0.40035 4.74777
210 5MPT SAH 0.01989 0.40564 4.83092
211 3LST SAH 0.02878 0.41044 4.88506
212 3WGT FAD 0.000000593 0.52751 4.89914
213 3WGT QSC 0.0000006466 0.52751 4.89914
214 1H5Q NAP 0.004037 0.41134 4.90566
215 2I7C AAT 0.0004262 0.40353 4.947
216 4BJZ P3A 0.0000002127 0.56601 4.95283
217 3G5S FAD 0.000000005523 0.57263 5
218 4MO2 FDA 0.00000003734 0.57124 5
219 4MO2 FAD 0.00000003835 0.56635 5
220 4G74 UQ5 0.0000000575 0.56271 5
221 3QVP FAD 0.00000004938 0.55894 5
222 4G74 FAD 0.00000001227 0.55751 5
223 5TS5 FAD 0.00000003051 0.55481 5
224 5I39 FAD 0.0000001781 0.54314 5
225 1Z82 NDP 0.002888 0.41979 5
226 5JJR SAH 0.01329 0.41389 5
227 2I3G NAP 0.0009786 0.43027 5.11364
228 3H9E NAD 0.00006827 0.40511 5.20231
229 5FJN BE2 0.00000008776 0.55343 5.26316
230 5FJN FAD 0.00000007835 0.5505 5.26316
231 1PS9 FAD 0.000000000334 0.62938 5.27778
232 4CNK FAD 0.000000002115 0.59157 5.27778
233 2IVD FAD 0.0000000169 0.58817 5.27778
234 5KMS FAD 0.00000005367 0.5702 5.27778
235 4YNU FAD 0.0000002839 0.53441 5.27778
236 4YNU LGC 0.0000004349 0.53352 5.27778
237 5EZ7 FAD 0.0000003503 0.52903 5.27778
238 1GPE FAD 0.0000000582 0.52296 5.27778
239 1UWK NAD 0.0001488 0.44205 5.27778
240 1UWK URO 0.0001488 0.44205 5.27778
241 5KMS NAD 0.000001588 0.43924 5.27778
242 5BR7 FAD 0.000001047 0.43491 5.27778
243 5BR7 FLC 0.000002219 0.42661 5.27778
244 1T26 NAI 0.0009752 0.41085 5.2795
245 2EV9 SKM 0.001115 0.42543 5.32319
246 1EQ2 NAP 0.0009318 0.43675 5.48387
247 2HJR APR 0.00002081 0.52437 5.4878
248 1HYH NAD 0.00004149 0.42655 5.50162
249 4J36 1HR 0.000000007553 0.58685 5.55556
250 4J36 FAD 0.0000000005209 0.58449 5.55556
251 2Y6Q I7T 0.00000001534 0.58111 5.55556
252 2Y6Q FAD 0.0000000004187 0.58051 5.55556
253 5MBX SP5 0.000000191 0.55242 5.55556
254 5MBX FAD 0.000000191 0.55242 5.55556
255 5HSA FAS 0.0000006179 0.51159 5.55556
256 3K7M FAD 0.00000004991 0.49158 5.55556
257 2IID PHE 0.0000001758 0.47316 5.55556
258 2IID FAD 0.0000001758 0.47316 5.55556
259 5CAE COA 0.001436 0.44127 5.55556
260 2HMT NAI 0.0000007031 0.44109 5.55556
261 2IXB NAD 0.002066 0.41772 5.55556
262 4PLG NAI 0.0003096 0.4175 5.68862
263 3GGO ENO 0.0009891 0.40959 5.73248
264 3GGO NAI 0.0009891 0.40959 5.73248
265 3NYC FAD 0.0000007928 0.52694 5.77428
266 3NYC IAR 0.0000007928 0.467 5.77428
267 1GV0 NAD 0.00005025 0.41967 5.80645
268 1GUZ NAD 0.00005313 0.41542 5.80645
269 1REO FAD 0.0000000319 0.55643 5.83333
270 5E4R NAP 0.003961 0.41167 5.83333
271 1X87 NAD 0.00001544 0.41421 5.98911
272 2G5C NAD 0.0002176 0.40229 6.04982
273 2F1K NAP 0.00002429 0.50806 6.09319
274 1H82 GZZ 0.00000003205 0.58734 6.11111
275 1PN0 IPH 0.00000004617 0.56746 6.11111
276 1PN0 FAD 0.00000004196 0.56746 6.11111
277 5G3U FDA 0.00000002449 0.55637 6.11111
278 2JB2 FAD 0.0000001649 0.54025 6.11111
279 5G3U ITW 0.0000002776 0.53474 6.11111
280 2JB2 PHE 0.0000002101 0.53274 6.11111
281 1H82 FAD 0.00000002149 0.4953 6.11111
282 5LD5 NAD 0.0002536 0.47725 6.14525
283 1HKU NAD 0.0002153 0.45567 6.14525
284 2AHR NAP 0.007358 0.40091 6.17761
285 1SAY PYR 0.0002793 0.41012 6.37119
286 1O94 ADP 0.0000000001114 0.55308 6.38889
287 5WGR FAD 0.0000001381 0.5389 6.38889
288 1DJN ADP 0.000000000291 0.53615 6.38889
289 3DMH SAM 0.005354 0.42581 6.38889
290 3EB9 FLC 0.01797 0.4048 6.39098
291 1SOW NAD 0.0001142 0.41655 6.40244
292 4XDY NAI 0.001328 0.43645 6.50888
293 2VYN NAD 0.00003397 0.42156 6.58683
294 4RDH AMP 0.000004395 0.59007 6.59722
295 5JCJ NAP 0.00109 0.43403 6.59722
296 3JQA NAP 0.001347 0.43323 6.59722
297 4CMI NAP 0.001166 0.43286 6.59722
298 5JDC NAP 0.001174 0.43275 6.59722
299 3JQG NAP 0.001415 0.43237 6.59722
300 4CM8 NAP 0.001232 0.43191 6.59722
301 3JQF NAP 0.001108 0.43092 6.59722
302 4CM4 NAP 0.001311 0.43084 6.59722
303 3BMQ NAP 0.001271 0.42859 6.59722
304 4CME NAP 0.002842 0.41742 6.59722
305 4CLO NAP 0.003595 0.41593 6.59722
306 3JQ7 NAP 0.004131 0.41348 6.59722
307 4RDI ATP 0.000005742 0.40281 6.59722
308 3OA2 NAD 0.003337 0.41464 6.60377
309 3GDH SAH 0.002651 0.42991 6.639
310 3OND ADN 0.0003536 0.43111 6.66667
311 3OND NAD 0.0003536 0.43111 6.66667
312 1GR0 NAD 0.0006801 0.40018 6.66667
313 3CIF NAD 0.00004404 0.41941 6.68524
314 3CIF G3H 0.0005161 0.4051 6.68524
315 5E8J SAH 0.009138 0.43209 6.73077
316 4NTD FAD 0.000000007711 0.57279 6.76471
317 1JG3 ADN 0.0001309 0.50786 6.80851
318 5FA8 SAM 0.01314 0.40273 6.8323
319 4D79 ATP 0.000004587 0.57593 6.88406
320 4CJX NAP 0.0003869 0.46198 6.89655
321 4BV6 FAD 0.000000001799 0.60455 6.94444
322 5X62 SAH 0.005213 0.43655 6.94444
323 1NPD NAD 0.002746 0.42926 6.94444
324 4XQC 13D 0.0003845 0.40895 6.94444
325 4XQC NAD 0.0004979 0.40868 6.94444
326 4XZ3 ACP 0.04577 0.41062 6.95652
327 5E5U MLI 0.01848 0.4212 7.03518
328 3B1J NAD 0.00006964 0.41809 7.07965
329 2DFV NAD 0.0001185 0.40035 7.20461
330 3SQP FAD 0.00000003047 0.64672 7.22222
331 3OZ2 FAD 0.000000008316 0.58018 7.22222
332 1KNR FAD 0.0000000704 0.5488 7.22222
333 2VHW NAI 0.00007756 0.43414 7.22222
334 3B1F NAD 0.00001086 0.40898 7.24138
335 1ZEM NAD 0.0003465 0.4605 7.25191
336 4GUS FAD 0.00000002123 0.5731 7.25806
337 4GUT FAD 0.00000002908 0.5715 7.25806
338 4HSU FAD 0.00000002656 0.56976 7.25806
339 4REP FAD 0.00000002154 0.56227 7.27273
340 1Y1P NMN AMP PO4 0.009821 0.40825 7.30994
341 3NTA FAD 0.000000007731 0.59055 7.5
342 3NT6 FAD 0.000000008279 0.57182 7.5
343 2Z3Y F2N 0.00000002624 0.56833 7.5
344 3GMB FAD 0.000000006881 0.55475 7.5
345 2XVE FAD 0.0000003078 0.55085 7.5
346 2XVF FAD 0.00000003493 0.54652 7.5
347 2B9W FAD 0.000001065 0.52713 7.54717
348 5HJM MTA 0.008734 0.41927 7.67045
349 1E6W NAD 0.00617 0.40162 7.69231
350 4MOP 2H5 0.0000001246 0.48587 7.77778
351 5U5G NAP 0.001776 0.42557 7.79661
352 1GZ6 NAI 0.002453 0.41484 7.83699
353 1LTH NAD 0.00002364 0.41176 7.83699
354 2V5E SCR 0.03178 0.40499 7.92079
355 3FPZ AHZ 0.0003766 0.48355 7.97546
356 1KYQ NAD 0.000001256 0.4207 8.0292
357 1OC2 NAD 0.001389 0.41647 8.04598
358 3NTD FAD 0.000000004852 0.57925 8.05556
359 3FG2 FAD 0.000000003651 0.55936 8.05556
360 2VVM FAD 0.00000003489 0.55911 8.05556
361 2VVL FAD 0.00000005302 0.55464 8.05556
362 2WET FAD 0.0000001316 0.54123 8.05556
363 5KOK SAH 0.02027 0.40237 8.05556
364 2DT5 NAD 0.00006867 0.4819 8.05687
365 1RP0 AHZ 0.000000006755 0.54428 8.09859
366 3BAZ NAP 0.002309 0.42945 8.10811
367 1V8B NAD 0.00009916 0.43109 8.33333
368 1NVM NAD 0.0002187 0.41032 8.4058
369 1MV8 NAD 0.00001667 0.4219 8.61111
370 1MUU NAD 0.00002372 0.4127 8.61111
371 3OFK SAH 0.001134 0.45252 8.7963
372 3NKS FAD 0.00000002351 0.57833 8.88889
373 5BVA FAD 0.000000006511 0.55781 8.88889
374 2AQJ FAD 0.0000002507 0.55293 8.88889
375 2AQJ TRP 0.0000002364 0.5527 8.88889
376 3WE0 FAD 0.0000006098 0.52157 8.88889
377 1U8X NAD 0.004008 0.41666 8.88889
378 4OBW SAM 0.0131 0.41418 8.94942
379 4IVN BMX 0.0292 0.4006 8.99281
380 1UXG NAD 0.00008262 0.43909 9.06149
381 3KLJ FAD 0.0000000001013 0.60657 9.16667
382 1N4W FAD 0.0000009985 0.51424 9.3254
383 4HA6 FAD 0.0000001956 0.53847 9.44444
384 2WMC MGP 0.0239 0.41758 9.55056
385 4YSX FAD 0.0000000163 0.57029 9.57447
386 2ZXI FAD 0.00000001428 0.58597 9.57614
387 4U8P FDA 0.0000003502 0.43174 9.72222
388 4U8P UDP 0.0000003962 0.42521 9.72222
389 1KPG SAH 0.003128 0.43304 9.7561
390 4BQS K2Q 0.04557 0.40695 10.2273
391 3EGV SAH 0.002324 0.45332 10.2362
392 2NXE SAM 0.004431 0.43629 10.2362
393 4D7E FAD 0.000001787 0.51568 10.2778
394 4TM3 FAD 0.0000009878 0.53965 10.8333
395 1T9D P22 0.03671 0.41597 10.8333
396 2PZM UDP 0.0002493 0.43217 10.9091
397 2PZM NAD 0.0002493 0.43217 10.9091
398 2GAG NAD 0.00000000007258 0.63466 11.1111
399 4OPC PGT 0.000000687 0.56909 11.1111
400 4OPC FDA 0.0000005152 0.56909 11.1111
401 2GAG FAD 0.000001893 0.50743 11.1111
402 2GAG FOA 0.000002506 0.50322 11.1111
403 4XUB 43D 0.02997 0.41307 11.1111
404 5HS2 CTP 0.008503 0.42992 11.2069
405 4EUE NAI 0.0001244 0.41647 11.244
406 1G27 BB1 0.02073 0.40478 11.3095
407 4J56 FAD 0.000000002004 0.60833 11.4035
408 5MQ6 NDP 0.00003379 0.51524 11.6667
409 1S17 GNR 0.01424 0.41249 11.6667
410 2QV7 ADP 0.02373 0.40805 11.8694
411 5BXV MGP 0.0472 0.41732 11.9792
412 2Q1W NAD 0.0000458 0.42944 12.012
413 1EJ4 M7G 0.02663 0.4367 12.1053
414 3AD8 NAD 0.00000000007014 0.61844 12.1212
415 3AD8 FAD 0.000005546 0.51046 12.1212
416 3AD8 PYC 0.000005546 0.40747 12.1212
417 3QV1 NAD 0.00002525 0.41555 12.1951
418 4II2 ATP 0.00001917 0.40297 12.2699
419 5ODQ FAD 0.0000000005694 0.60512 12.5
420 1QO8 FAD 0.000000003968 0.59467 12.5
421 4RSL FAD 0.000001105 0.52316 12.5
422 4QTU SAM 0.002987 0.4407 12.5926
423 1YY5 FAD 0.0000000165 0.57686 13.0556
424 1RSG FAD 0.00000003138 0.56405 13.0556
425 2NPX FAD 0.00000001934 0.58133 13.6111
426 2NPX NAD 0.0000001532 0.4644 13.6111
427 1J0X NAD 0.0002914 0.42985 13.8554
428 5TTJ FAD 0.00000004431 0.55983 13.8889
429 2A8X FAD 0.000000001575 0.61015 14.0086
430 1FEC FAD 0.000000003146 0.60493 14.1667
431 5VN0 FAD 0.000000005084 0.59688 14.1667
432 5VN0 NAI 0.0000001673 0.46149 14.1667
433 4M52 FAD 0.0000000009519 0.61581 14.3777
434 3S5W FAD 0.000000009139 0.53762 14.4444
435 4NTC FAD 0.000000003775 0.59362 15.2239
436 5DX8 SFG 0.006221 0.41689 15.7895
437 5DXA SFG 0.006342 0.41653 15.7895
438 1GTE FAD 0.0000000066 0.6108 17.2222
439 1YQZ FAD 0.00000002745 0.58735 17.2222
440 2CUL FAD 0.000000132 0.51973 17.2414
441 4K28 NAD 0.00019 0.47492 17.4721
442 3NJ4 NAD 0.002437 0.43503 17.5
443 3NJ4 AFX 0.004336 0.42521 17.5
444 1Q1R FAD 0.000000003691 0.60671 17.7778
445 3QFA FAD 0.0000000008326 0.59957 18.1034
446 3GD4 NAD 0.0000000447 0.59392 18.3333
447 3GD4 FAD 0.0000000202 0.59086 18.3333
448 2YG3 FAD 0.00000002381 0.56473 18.3333
449 1Q9I TEO 0.00000003646 0.48477 18.3333
450 1Q9I FAD 0.00000003646 0.48477 18.3333
451 5C2N NAG 0.03236 0.41923 18.75
452 2CDU FAD 0.0000000005049 0.6018 20
453 2CDU ADP 0.00000003684 0.44502 20
454 4USQ FAD 0.00000001216 0.54941 20.2778
455 1LSS NAD 0.000002517 0.42148 20.7143
456 3LAD FAD 0.000000001198 0.6124 21.1111
457 5JCM FAD 0.00000003329 0.58906 21.3889
458 5JCM NAD 0.00000003577 0.58906 21.3889
459 5JCM ISD 0.00000003577 0.58906 21.3889
460 3UOY NAP 0.0000002516 0.56037 21.3889
461 3UOY FAD 0.0000002516 0.43271 21.3889
462 2WPF WPF 0.00000004776 0.60941 21.9444
463 2WPF FAD 0.00000004456 0.6082 21.9444
464 3LXD FAD 0.000000002589 0.57296 22.2222
465 4USR FAD 0.000000009731 0.54701 22.2222
466 5J7X FAD 0.0000002761 0.53652 22.7778
467 5U8U FAD 0.000000002771 0.48644 22.7778
468 2RAB NAD 0.00000000109 0.64533 23.0556
469 2RAB FAD 0.0000000002007 0.64266 23.0556
470 1BZL FAD 0.00000008729 0.59783 23.0556
471 3UCL NAP 0.000001013 0.53924 23.0556
472 3UCL CYH 0.0000008434 0.53924 23.0556
473 3UCL FAD 0.0000008434 0.53924 23.0556
474 1D4D FAD 0.000000007257 0.58745 23.3333
475 2V6O FAD 0.000000009124 0.45427 25.5556
476 2V3A FAD 0.000000001261 0.5987 26.1111
477 5L95 AMP 0.00004416 0.52467 26.25
478 4D04 NAP 0.000000134 0.56607 26.3889
479 4D04 FAD 0.000000134 0.45066 26.3889
480 1ZK7 FAD 0.0000000003506 0.59152 27.2222
481 4AP3 NAP 0.0000001876 0.55858 27.5
482 4AP3 FAD 0.0000001876 0.45491 27.5
483 3ICS FAD 0.000000001841 0.59311 28.3333
484 3ICR FAD 0.000000001635 0.59005 28.3333
485 3ICT FAD 0.000000006819 0.5703 28.3333
486 3ICT ADP 0.00000000245 0.44102 28.3333
487 3ICS ADP 0.000000002878 0.44005 28.3333
488 1LVL NAD 0.00000002741 0.66397 28.3843
489 1LVL FAD 0.000000002016 0.58013 28.3843
490 2V3B FAD 0.000000001104 0.59599 29.0909
491 2HQM FAD 0.000000001038 0.61453 29.7222
492 4EMI NAD 0.00000002096 0.59277 31.1111
493 4EMI FAD 0.000000002089 0.59149 31.1111
494 4EMJ FAD 0.000000007476 0.57767 31.1111
495 3CGB FAD 0.000000001511 0.5918 33.6111
496 1GET NAP 0.00000000434 0.62584 34.4444
497 1GET FAD 0.000000003744 0.62584 34.4444
498 2F5Z FAD 0.0000000003939 0.63076 34.7222
499 4YRY FAD 0.0000000004585 0.60793 34.7222
500 1ZMD FAD 0.0000000002808 0.60763 34.7222
501 1ZMD NAI 0.0000001437 0.60572 34.7222
502 4YRY NAD 0.000000002323 0.52889 34.7222
503 5JCA NDP 0.000000002494 0.62727 35
504 5JCA FAD 0.0000000004677 0.62634 35
505 4JNA FAD 0.000000004714 0.59212 35.2941
506 1XHC FAD 0.00000000048 0.60232 35.4223
507 3RNM FAD 0.0000000004164 0.62994 35.5556
508 4JDR FAD 0.00000000008347 0.6397 36.1111
509 1V59 FAD 0.0000000004447 0.63258 36.3889
510 1V59 NAD 0.00000000174 0.44672 36.3889
511 3ITJ FAD 0.000000001769 0.61684 37.574
512 3CGD NAD 0.00000004103 0.5982 38.0556
513 3CGD COA 0.00000004103 0.5982 38.0556
514 3CGD FAD 0.00000004103 0.5982 38.0556
515 3CTY FAD 0.00000000003602 0.6683 38.2445
516 1TDF FAD 0.0000000003225 0.63916 39.557
517 1TDF NAP 0.000000003338 0.63229 39.557
518 1VDC FAD 0.000000001933 0.61389 40.8408
519 3F8D FAD 0.000000002987 0.63406 41.7957
520 1MO9 KPC 0.000000007829 0.62696 41.9444
521 1MO9 FAD 0.000000008422 0.62479 41.9444
522 5J60 FAD 0.0000000005636 0.61972 42.1875
523 2Q0L FAD 0.000000000431 0.62563 43.7299
524 1FL2 FAD 0.00000000001749 0.6659 44.5161
525 4UP3 FAD 0.0000000002078 0.63438 44.586
526 2Q7V FAD 0.000000000008923 0.68282 46.1538
Pocket No.: 2; Query (leader) PDB : 3AB1; Ligand: FAD; 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: 3ab1.bio1) has 36 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
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