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Receptor
PDB id Resolution Class Description Source Keywords
1H5Q 1.5 Å EC: 1.1.1.138 MANNITOL DEHYDROGENASE FROM AGARICUS BISPORUS AGARICUS BISPORUS OXIDOREDUCTASE MANNITOL METABOLISM
Ref.: THE CRYSTALLOGRAPHIC STRUCTURE OF THE MANNITOL 2-DEHYDROGENASE NADP+ BINARY COMPLEX FROM AGARICUS BISPORUS J.BIOL.CHEM. V. 276 27555 2001
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
NAP A:263;
B:263;
C:263;
D:263;
E:263;
F:263;
G:263;
H:263;
I:263;
J:263;
K:263;
L:263;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
743.405 C21 H28 N7 O17 P3 c1cc(...
NI A:2263;
B:2263;
E:3263;
F:3263;
I:3263;
J:3263;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
none;
none;
none;
none;
none;
none;
submit data
58.693 Ni [Ni+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1H5Q 1.5 Å EC: 1.1.1.138 MANNITOL DEHYDROGENASE FROM AGARICUS BISPORUS AGARICUS BISPORUS OXIDOREDUCTASE MANNITOL METABOLISM
Ref.: THE CRYSTALLOGRAPHIC STRUCTURE OF THE MANNITOL 2-DEHYDROGENASE NADP+ BINARY COMPLEX FROM AGARICUS BISPORUS J.BIOL.CHEM. V. 276 27555 2001
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 1H5Q - NAP C21 H28 N7 O17 P3 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 1 families.
1 1H5Q - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
50% Homology Family (47)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 2VZ0 Ki = 9.8 nM D64 C15 H14 N4 Cc1ccc(cc1....
2 1VL8 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
3 1X7G - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
4 2RH4 Ki = 15 uM EMO C15 H10 O5 Cc1cc2c(c(....
5 4N5M - CAA C25 H40 N7 O18 P3 S CC(=O)CC(=....
6 4BNV ic50 = 0.03 uM Q7U C15 H13 Cl N4 O Cn1c2ccccc....
7 4BO1 ic50 = 0.05 uM NKH C18 H15 Cl N2 O3 COc1cc(c(c....
8 4BO0 ic50 = 0.2 uM FXE C17 H18 N4 O3 Cn1c2cccc(....
9 1H5Q - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
10 2AE2 - PTO C8 H15 N O CN1[C@H]2C....
11 1NFF - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
12 1XKQ - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
13 5YSS - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
14 3SJ7 Kd = 53.93 uM NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
15 1ZEM - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
16 5O43 Ki = 42 nM 9JQ C18 H14 F2 N2 O2 CN(c1ccc(c....
17 5EN4 Ki = 64 nM 5Q6 C18 H12 F N O4 c1cc(c(c(c....
18 5O6X Ki = 6 nM 9MK C17 H12 F N O2 Cc1ccc2c(c....
19 5L7T Ki = 26 nM 6QJ C19 H14 F N O3 Cc1cc(ccc1....
20 1ZJZ - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
21 1ZJY - NAI C21 H29 N7 O14 P2 c1nc(c2c(n....
22 2WDZ - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
23 2Q2V - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
24 3NUG - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
25 1G0O Ki = 14 nM PYQ C11 H11 N O c1cc2c3c(c....
26 4GH5 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
27 1RWB - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
28 5Z2L Kd = 45 uM NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
29 5T2U - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
30 4NBU - CAA C25 H40 N7 O18 P3 S CC(=O)CC(=....
31 4KWH - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
32 4KWI - 1TJ C19 H12 O5 Cc1cc2c(c(....
33 5OJG - BUO C4 H6 O2 CC(=O)C(=O....
34 2CFC - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
35 3ICC - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
36 3AI3 - SOE C6 H12 O6 C1[C@@H]([....
37 1AHI - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
38 5B4T - 3HR C4 H8 O3 C[C@H](CC(....
39 3VDQ - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
40 2DTX - BMA C6 H12 O6 C([C@@H]1[....
41 2DTE - NAI C21 H29 N7 O14 P2 c1nc(c2c(n....
42 2AG5 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
43 1JA9 Ki = 420 nM PYQ C11 H11 N O c1cc2c3c(c....
44 1UZN Kd = 11.2 uM NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
45 3QWF - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
46 3AFN - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
47 1XHL - TNE C8 H13 N O CN1[C@H]2C....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: NAP; Similar ligands found: 123
No: Ligand ECFP6 Tc MDL keys Tc
1 NAP 1 1
2 NA0 0.881356 0.986301
3 TAP 0.872881 0.934211
4 NDO 0.840336 0.972603
5 NAD 0.811966 0.986111
6 N01 0.733871 0.958904
7 A3D 0.712 0.972603
8 NBP 0.707692 0.935065
9 NHD 0.68254 0.958904
10 NJP 0.661417 0.972973
11 NFD 0.658915 0.934211
12 NXX 0.619048 0.959459
13 DND 0.619048 0.959459
14 AMP NAD 0.606061 0.958904
15 ZID 0.605839 0.972603
16 NAQ 0.59854 0.922078
17 ATR 0.59292 0.917808
18 NAE 0.591241 0.946667
19 NDE 0.58042 0.986301
20 A22 0.571429 0.958904
21 NAJ 0.567164 0.986111
22 A2R 0.563025 0.932432
23 NDC 0.561644 0.922078
24 NA7 0.552846 0.907895
25 ODP 0.551471 0.935065
26 A2P 0.539823 0.930556
27 8ID 0.537313 0.910256
28 NPW 0.525547 0.8875
29 NZQ 0.521739 0.910256
30 CNA 0.521739 0.959459
31 NDP 0.514493 0.922078
32 PO4 PO4 A A A A PO4 0.503937 0.930556
33 1DG 0.503401 0.922078
34 DG1 0.503401 0.922078
35 TXP 0.5 0.922078
36 NMN AMP PO4 0.492958 0.921053
37 XNP 0.492958 0.875
38 25L 0.492308 0.958904
39 25A 0.492063 0.972222
40 NMN 0.486726 0.888889
41 NGD 0.485714 0.935065
42 9JJ 0.481707 0.8875
43 2AM 0.477876 0.891892
44 ADP 0.458333 0.945205
45 PAP 0.451613 0.931507
46 A2D 0.445378 0.945205
47 AN2 0.442623 0.932432
48 7L1 0.441558 0.777778
49 ADP PO3 0.44 0.944444
50 SAP 0.44 0.896104
51 AGS 0.44 0.896104
52 M33 0.439024 0.906667
53 AR6 AR6 0.438849 0.945205
54 BA3 0.438017 0.945205
55 OAD 0.43609 0.92
56 ADP BMA 0.43609 0.92
57 DQV 0.435714 0.958904
58 HEJ 0.435484 0.945205
59 ATP 0.435484 0.945205
60 OOB 0.435115 0.958904
61 B4P 0.434426 0.945205
62 AP5 0.434426 0.945205
63 GAP 0.433071 0.92
64 0WD 0.432432 0.922078
65 2A5 0.432 0.87013
66 5FA 0.432 0.945205
67 AQP 0.432 0.945205
68 AT4 0.430894 0.907895
69 00A 0.428571 0.909091
70 DAL AMP 0.427481 0.932432
71 CA0 0.427419 0.92
72 ADP ALF 0.426357 0.871795
73 ALF ADP 0.426357 0.871795
74 9X8 0.425373 0.871795
75 ACP 0.424 0.92
76 NAJ PZO 0.423841 0.897436
77 9SN 0.423358 0.897436
78 ADP VO4 0.423077 0.932432
79 VO4 ADP 0.423077 0.932432
80 WAQ 0.422222 0.884615
81 V3L 0.421875 0.945205
82 ACQ 0.421875 0.92
83 ADQ 0.421053 0.92
84 AR6 0.420635 0.918919
85 APR 0.420635 0.918919
86 ATP A A A 0.42029 0.958333
87 CO7 0.419753 0.786517
88 3OD 0.419118 0.92
89 1ZZ 0.419118 0.841463
90 DLL 0.41791 0.958904
91 AD9 0.417323 0.92
92 NAX 0.416667 0.875
93 OVE 0.416667 0.857143
94 MYR AMP 0.416058 0.841463
95 AV2 0.415385 0.868421
96 A3P 0.414634 0.944444
97 NNR 0.414414 0.72973
98 OMR 0.413793 0.831325
99 6YZ 0.412214 0.92
100 ANP 0.410853 0.92
101 A1R 0.410448 0.860759
102 ABM 0.409836 0.893333
103 A 0.408333 0.944444
104 AMP 0.408333 0.944444
105 SON 0.408 0.933333
106 PPS 0.407692 0.829268
107 5AL 0.407692 0.932432
108 NAI 0.406897 0.909091
109 7D3 0.406504 0.857143
110 ADX 0.404762 0.829268
111 ATF 0.40458 0.907895
112 3UK 0.404412 0.945946
113 TYR AMP 0.404255 0.921053
114 AMP DBH 0.404255 0.894737
115 139 0.402685 0.875
116 50T 0.401575 0.906667
117 SRP 0.401515 0.907895
118 A A 0.40146 0.972222
119 B5V 0.40146 0.933333
120 A3R 0.4 0.860759
121 3AM 0.4 0.90411
122 B5M 0.4 0.921053
123 FA5 0.4 0.933333
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1H5Q; Ligand: NAP; Similar sites found with APoc: 503
This union binding pocket(no: 1) in the query (biounit: 1h5q.bio1) has 28 residues
No: Leader PDB Ligand Sequence Similarity
1 1LSS NAD None
2 3P13 RIP None
3 5T9F TYR None
4 5T9F NAP None
5 2G5C NAD None
6 5T9E NAP None
7 1RJD SAM None
8 1B8U NAD 1.21581
9 2XVM SAH 1.50754
10 5OCQ CIT 1.50943
11 1I9G SAM 1.50943
12 6AA8 NAD 1.50943
13 3GGO NAI 1.50943
14 3GGO ENO 1.50943
15 3LU1 NAD 1.88679
16 1E7S NAP 1.88679
17 5Z75 NAD 1.88679
18 1P77 ATR 1.88679
19 1ZQ9 SAM 1.88679
20 5MDH NAD 1.88679
21 4MDH NAD 1.88679
22 1GPE FAD 1.88679
23 4C4A SAH 1.88679
24 1SC6 NAD 1.88679
25 6ER9 FAD 1.88679
26 3ICT FAD 1.88679
27 1Q8Q MAN MMA 1.98413
28 1Q8S MAN MMA 1.98413
29 1RKX NAD 2.26415
30 1V6A TRE 2.26415
31 2HJR APR 2.26415
32 3A27 SAM 2.26415
33 1GV0 NAD 2.26415
34 2GZ3 NAP 2.26415
35 5LD5 NAD 2.26415
36 5XVH NAP 2.26415
37 3G2O SAM 2.26415
38 6C4N NAP 2.26415
39 1COY FAD 2.26415
40 1X87 NAD 2.26415
41 2OBF SAH 2.26415
42 1YS4 NAP 2.26415
43 4DPL NAP 2.26415
44 2OBF F83 2.26415
45 1COY AND 2.26415
46 5MIT FAD 2.26415
47 5MIT NAP 2.26415
48 5DNK SAH 2.26415
49 5BVA FAD 2.26415
50 1I36 NAP 2.27273
51 2DT5 NAD 2.36967
52 5OOH NAP 2.42718
53 5OOH 9ZZ 2.42718
54 2WA2 SAM 2.53623
55 1VM6 NAD 2.63158
56 4B4U NAP 2.64026
57 5MLR NAP 2.64151
58 5MLR GRQ 2.64151
59 2V6G NAP 2.64151
60 6EL3 NAP 2.64151
61 5L4L 7OX 2.64151
62 5L4L NAP 2.64151
63 2PK3 A2R 2.64151
64 1UXG FUM 2.64151
65 1UXG NAD 2.64151
66 3A06 NDP 2.64151
67 2C5A GDC 2.64151
68 2C5A NAD 2.64151
69 3A06 FOM 2.64151
70 5OJL TXP 2.64151
71 1T26 NAI 2.64151
72 1T26 GBD 2.64151
73 6CEP OXM 2.64151
74 6CEP NAD 2.64151
75 3H8V ATP 2.64151
76 1GTE FAD 2.64151
77 3PT9 SAH 2.64151
78 5NA1 FAD 2.64151
79 5NN0 92H 2.64151
80 2JHP SAH 2.64151
81 1WP4 NDP 2.64151
82 1EZ4 NAD 2.64151
83 3N8K D1X 2.90698
84 3CGB FAD 2.91667
85 1A5Z NAD 3.01887
86 5ERG SAM 3.01887
87 4D3F NAP 3.01887
88 2YX1 SFG 3.01887
89 1PN0 FAD 3.01887
90 1PN0 IPH 3.01887
91 4L8V NAP 3.01887
92 1V59 NAD 3.01887
93 3L4S NAD 3.01887
94 3L4S 3PG 3.01887
95 3V1Y NAD 3.01887
96 1HDR NAD 3.27869
97 4ZRN NAD 3.39623
98 1SB8 UD2 3.39623
99 4ZRN UPG 3.39623
100 1SB8 NAD 3.39623
101 3WMX NAD 3.39623
102 2Q1W NAD 3.39623
103 5K4W THR 3.39623
104 5K4W NAI 3.39623
105 1Q0H FOM 3.39623
106 1Q0H NDP 3.39623
107 3O9Z AKG 3.39623
108 5ZYN FAD 3.39623
109 3O9Z NAD 3.39623
110 5X9D 80F 3.39623
111 1DSS NAD 3.39623
112 3SSO SAH 3.39623
113 1NVM NAD 3.39623
114 5JE8 NAD 3.39623
115 5XLX SAH 3.39623
116 4M37 SAH 3.39623
117 2A92 NAI 3.39623
118 2CUL FAD 3.44828
119 1HDG NAD 3.61446
120 6BWL NAD 3.77358
121 2YY7 NAD 3.77358
122 1RPN NDP 3.77358
123 2UYQ SAM 3.77358
124 3X0D SAH 3.77358
125 5A1T NAI 3.77358
126 4OM8 NAD 3.77358
127 3ABI NAD 3.77358
128 2F1K NAP 3.77358
129 3O7W SAM 3.77358
130 2CVQ NDP 3.77358
131 2J5V RGP 3.77358
132 1LDM NAD 3.77358
133 3OA2 NAD 3.77358
134 1NYT NAP 3.77358
135 5BRT FAD 3.77358
136 5BRT CH9 3.77358
137 5A1T OXM 3.77358
138 4KOA NDP 3.77358
139 1GZ4 ATP 3.77358
140 5KMS NAD 3.77358
141 5XNC MTA 3.77358
142 1O0S NAI 3.77358
143 3QVP FAD 3.77358
144 4RDH AMP 3.81944
145 4AVV CD 3.92157
146 4AVV GHE 3.92157
147 1N7G NDP 4.15094
148 1N7G GDR 4.15094
149 3VPH OXM 4.15094
150 5NUF NAD 4.15094
151 4E13 NAD 4.15094
152 5JAQ NAI 4.15094
153 3VPH NAD 4.15094
154 5NUE NAD 4.15094
155 4C3Y FAD 4.15094
156 1HYH NAD 4.15094
157 2EJU SAH 4.15094
158 4C3Y ANB 4.15094
159 1UP7 NAD 4.15094
160 4PVD NDP 4.5283
161 4ZVV NAD 4.5283
162 1UWK NAD 4.5283
163 1UWK URO 4.5283
164 4ZVV GN0 4.5283
165 9LDB NAD 4.5283
166 2HK9 ATR 4.5283
167 9LDT NAD 4.5283
168 3B1F NAD 4.5283
169 1LDN NAD 4.5283
170 2HK9 NAP 4.5283
171 5XVS UDP 4.5283
172 5G1N PAL 4.5283
173 5J60 FAD 4.6875
174 4G5H UD7 4.90566
175 4G5H NAP 4.90566
176 5IN4 6CK 4.90566
177 5IN4 GDP 4.90566
178 5IN4 NAP 4.90566
179 1F8G NAD 4.90566
180 6C4T NA7 4.90566
181 1PJS NAD 4.90566
182 2I3G NAP 4.90566
183 6DAW ARG 4.90566
184 2P41 SAH 4.90566
185 1NAA 6FA 4.90566
186 1NAA ABL 4.90566
187 1GAD NAD 4.90566
188 3MB5 SAM 5.09804
189 1OC2 TDX 5.28302
190 1OC2 NAD 5.28302
191 1Y1P NMN AMP PO4 5.28302
192 3WQQ NDP 5.28302
193 3WQQ IB3 5.28302
194 4KP7 NAP 5.28302
195 4KP7 1UQ 5.28302
196 2PZM UDP 5.28302
197 2PZM NAD 5.28302
198 5UAV NDP 5.28302
199 3H9E NAD 5.28302
200 3EVG SAH 5.28302
201 5UAV TFB 5.28302
202 1QO8 FAD 5.28302
203 3C1O NAP 5.28302
204 1OGD RIP 5.34351
205 2C29 DQH 5.66038
206 2C29 NAP 5.66038
207 1O6Z NAD 5.66038
208 1LTH NAD 5.66038
209 4XB2 NDP 5.66038
210 1NE7 16G 5.66038
211 3H5N ATP 5.66038
212 4AT0 FAD 5.66038
213 1SOW NAD 5.66038
214 4Z0H NAD 5.66038
215 5Y1G AKB 6.03774
216 5Y1G NAD 6.03774
217 2IZ1 ATR 6.03774
218 6DNT NAD 6.41509
219 1V35 NAI 6.41509
220 1GUZ NAD 6.41509
221 4MOP 2H5 6.41509
222 4RSL FAD 6.41509
223 2X6T NAP 6.44258
224 3KO8 NAD 6.73077
225 5F5N NAD 6.79245
226 1HYE NAP 6.79245
227 2PV7 NAD 6.79245
228 3T31 FAD 6.79245
229 3T31 DCQ 6.79245
230 4N49 SAM 6.79245
231 4U7W NDP 7.16981
232 2DKH FAD 7.16981
233 5OCM NAP 7.16981
234 1WDK NAD 7.16981
235 5TC4 NAD 7.16981
236 5KOX RFP 7.16981
237 5KOX FAD 7.16981
238 1T66 FLU 7.30594
239 3W9F I3P 7.30769
240 1EQ2 NAP 7.41935
241 4J7U NAP 7.54717
242 4J7U YTZ 7.54717
243 1Z6Z NAP 7.54717
244 4GKV NAD 7.54717
245 1BXK NAD 7.92453
246 1U1I NAD 7.92453
247 1TI7 NAP 7.92453
248 2VUT NAD 7.92453
249 1NVT NAP 7.92453
250 4MIG G3F 7.92453
251 1MV8 NAD 7.92453
252 1MUU NAD 7.92453
253 4FZV SAM 7.94979
254 2QZZ NAP 8.1761
255 2QZZ EMF 8.1761
256 2BKA NDP 8.26446
257 2Q1S NAI 8.30189
258 3L9W AMP 8.30189
259 1BW9 NAD 8.30189
260 3CIF G3H 8.30189
261 3CIF NAD 8.30189
262 2HMT NAI 8.33333
263 5BJX NAD 8.67924
264 5BJX UDP 8.67924
265 5DF1 58X 8.67924
266 5DF1 NAP 8.67924
267 5ZI2 NAD 8.67924
268 5ZI2 ADP 8.67924
269 2EXX NAP 8.67924
270 4ZGS NAD 8.67924
271 1VKO NAD 8.67924
272 1CER NAD 8.67924
273 1E5Q NDP 8.67924
274 2JL1 NAP 8.7108
275 5ZEC NAP 9.0566
276 5MSO NAP 9.0566
277 4LWP SAH 9.0566
278 5ZZ6 ADP 9.0566
279 2PWY SAH 9.0566
280 5ZZ6 NAD 9.0566
281 1Z45 NAD 9.43396
282 4R1S NAP 9.43396
283 4PLT OXM 9.81132
284 4PLT NAI 9.81132
285 2VT3 ATP 9.81132
286 5L95 AMP 10
287 4YSX FAD 10.1887
288 4PLG NAI 10.9434
289 4PLG OXM 10.9434
290 5KKA 6V0 10.9434
291 3QV1 NAD 10.9756
292 4GLL NAD 11.3208
293 4XQC 13D 11.3208
294 4XQC NAD 11.3208
295 3CGD FAD 11.3208
296 3CGD NAD 11.3208
297 3CGD COA 11.3208
298 1WVG APR 11.6981
299 1R6D NAD 12.0755
300 1R6D DAU 12.0755
301 1I2B UPG 12.0755
302 1I2B NAD 12.0755
303 1I2B USQ 12.0755
304 1RM0 D6P 12.4528
305 1RM0 NAI 12.4528
306 4OHU 2TK 12.8302
307 4OHU NAD 12.8302
308 4OOE FOM 12.8302
309 4OOE NDP 12.8302
310 5UAO FAD 12.8302
311 1EK6 NAI 13.5849
312 1EK6 UPG 13.5849
313 3RGG AIR 13.8365
314 3I6I NDP 13.9623
315 5YEC ATP 14.2857
316 4TQG NDP 14.3396
317 3ORF NAD 14.3426
318 2GN4 UD1 14.717
319 2GN4 NDP 14.717
320 4D79 ATP 14.717
321 1PZG A3D 14.717
322 3ENV ABF 14.717
323 3O26 NDP 15.4717
324 4PIV NDP 15.4717
325 4EUE NAI 15.4717
326 2NVK NAP 15.8491
327 1ORR NAD 15.8501
328 2Q46 NAP 16.6008
329 3RFV NAI 16.6038
330 3RFV 15L 16.6038
331 2B4R NAD 16.6038
332 2B4R AES 16.6038
333 2FR1 NDP 16.9811
334 2OOR NAD 17.2414
335 4HXY NDP 17.3585
336 1VL0 NAI 18.8679
337 4J1Q NDP 19.2453
338 5L4S 6KX 20.3774
339 5L4S NAP 20.3774
340 3H4V DVP 20.3774
341 3H4V NAP 20.3774
342 3A4V PYR 20.7547
343 3A4V NAD 20.7547
344 4GQB 0XU 22.7273
345 4M38 SAH 23.8095
346 4K26 NDP 24.1509
347 4K26 SFF 24.1509
348 3CH6 NAP 24.1509
349 3CH6 311 24.1509
350 1N5D NDP 25.283
351 1WMA NDP 25.6604
352 1WMA AB3 25.6604
353 1XSE NDP 26.7925
354 1UDB NAD 26.7925
355 1UDB UFG 26.7925
356 5O98 NAP 28.3019
357 1NNU NAD 28.3333
358 1NNU TCT 28.3333
359 5GT9 NAP 29.6578
360 1GY8 NAD 30.1887
361 1KEW NAD 30.9434
362 1KEW TYD 30.9434
363 4YAC NAI 31.6981
364 4YAG NAI 32.0755
365 5XWV 8H6 32.8302
366 5XWV NDP 32.8302
367 1GZ6 NAI 32.8302
368 3RJ5 NAD 33.0709
369 3HB5 NAP 33.2075
370 1A27 NAP 33.2075
371 4Y9D NAI 33.2075
372 4O1M NAD 33.9623
373 3RKR NAP 33.9695
374 3V1U NAD 34.3396
375 1OAA OAA 34.749
376 2BGM NAJ 35.0943
377 3WXB NDP 36.6038
378 1ZBQ NAD 36.9811
379 4OSP NAP 37.3585
380 5WQP NAP 37.6068
381 5WQP NCA 37.6068
382 3ZV6 NAD 37.7358
383 3ZV6 4HB 37.7358
384 1W8D NAP 37.7358
385 1W73 NAP 37.7358
386 1UAY ADN 38.0165
387 2JAH NDP 38.0567
388 1E6W NAD 38.1132
389 1E3W NAD 38.1132
390 1SNY NAP 38.1132
391 2PD4 NAD 38.1132
392 2PD4 DCN 38.1132
393 2JAP NDP 38.4615
394 2BD0 NAP 38.5246
395 1U7T TDT 38.6973
396 1U7T NAD 38.6973
397 3OIG NAD 38.8679
398 1W6U NAP 39.2453
399 5L53 NAP 39.2453
400 3OJF NDP 39.2453
401 3OJF IMJ 39.2453
402 1MXH DHF 39.6226
403 1MXH NAP 39.6226
404 3GEG NAD 39.6761
405 4FC7 NAP 40
406 4FC7 COA 40
407 3TN7 NJP 40.0778
408 1G0N PHH 40.7547
409 1G0N NDP 40.7547
410 5I7S NAD 40.7547
411 5I7S E9P 40.7547
412 1BDB NAD 41.1321
413 4ZU3 4SD 41.4097
414 4D42 W0I 41.5094
415 4D42 NAP 41.5094
416 5G4L NDP 41.5094
417 2WYV NAD 41.5094
418 5WUW NAP 42.2642
419 6F9Q NAD 42.2642
420 4Q9N NAI 42.2642
421 3QWI NAP 42.6415
422 3QWI CUE 42.6415
423 1FK8 NAD 43.0189
424 3U4C NDP 43.0189
425 1QG6 NAD 43.0189
426 1QG6 TCL 43.0189
427 5CG1 NAD BBN 43.0189
428 2GDZ NAD 43.3962
429 1X1T NAD 43.3962
430 2DKN NAI 43.5294
431 3VZS NAP 43.5798
432 3VZS CAA 43.5798
433 1XG5 NAP 43.7736
434 2ZAT NAP 43.8462
435 4URF NAD 43.9516
436 4QED NAP 44.1509
437 5OJI NAP 44.2308
438 5OJI ISN 44.2308
439 4NBW NAD 44.5283
440 3OID NDP 44.5283
441 2WD7 NAP 44.5283
442 3SJU NDP 44.5283
443 2WD7 VGD 44.5283
444 5GWT SIN 44.9057
445 5GWT NAD 44.9057
446 1IY8 NAD 44.9057
447 1D7O NAD 44.9057
448 1D7O TCL 44.9057
449 1HDC CBO 45.2756
450 2B4Q NAP 45.283
451 1GEG NAD 45.3125
452 4ITU 1HS 45.3532
453 4ITU NAI 45.3532
454 1NFQ NAI 45.3846
455 5EJ2 NAD 45.6604
456 3AY6 NAI 46.0377
457 3AY6 BGC 46.0377
458 5THQ NDP 46.0377
459 4FN4 NAD 46.063
460 4RF2 NAP 46.4151
461 6CI9 NAP 46.7181
462 1AE1 NAP 46.7925
463 1GEE NAD 47.1264
464 5EPO NAP 47.3282
465 2EWM NAD 47.3896
466 4CM9 NAP 47.5472
467 3JQ7 NAP 47.5472
468 3BMN NAP 47.5472
469 5JDC NAP 47.5472
470 4CLR NAP 47.5472
471 4CMI NAP 47.5472
472 4CLO NAP 47.5472
473 3JQ9 NAP 47.5472
474 4CME NAP 47.5472
475 5K6A NAP 47.5472
476 5JCJ NAP 47.5472
477 3JQA NAP 47.5472
478 3JQF NAP 47.5472
479 4CM4 NAP 47.5472
480 3JQG NAP 47.5472
481 3BMO NAP 47.5472
482 3JQB NAP 47.5472
483 3BMQ NAP 47.5472
484 3JQ8 NAP 47.5472
485 5JDI NAP 47.5472
486 4CM8 NAP 47.5472
487 3JQ8 DX3 47.5472
488 4CME KTZ 47.5472
489 5O42 NAD 47.9245
490 5O42 BGC 47.9245
491 5O42 9JW 47.9245
492 4ZA2 NAD 47.9245
493 1ZK4 NAP 48.2072
494 1ZK4 AC0 48.2072
495 5FEU NAP 48.3019
496 1Q7B NAP 48.3607
497 3D3W NAP 48.3607
498 1PR9 NAP 48.3607
499 3A28 NAD 49.2248
500 4O0L NDP 49.4545
501 5FFF NAP 49.8054
502 5FFF 5XC 49.8054
503 1YXM ADE 49.8113
504 4NBT NAD 50
Pocket No.: 2; Query (leader) PDB : 1H5Q; Ligand: NAP; Similar sites found with APoc: 423
This union binding pocket(no: 2) in the query (biounit: 1h5q.bio1) has 31 residues
No: Leader PDB Ligand Sequence Similarity
1 3GCZ SAM None
2 5E9W SAH None
3 5E8J SAH None
4 4POO SAM None
5 1LNX URI None
6 2PXX SAH 0.930233
7 6A0S NDP 1.13208
8 6A0S HSE 1.13208
9 5ULP KB1 1.13208
10 1LLU NAD 1.13208
11 1B8U OAA 1.21581
12 5D4V SAH 1.50943
13 4OPC PGT 1.50943
14 4OPC FDA 1.50943
15 1CF2 NAP 1.50943
16 6ECU SAH 1.50943
17 5Z2F NAP 1.50943
18 3CBG SAH 1.72414
19 3ICS ADP 1.88679
20 3ICT ADP 1.88679
21 5U5G NAP 1.88679
22 1J0X NAD 1.88679
23 2C7G FAD 1.88679
24 5FJN FAD 1.88679
25 5FJN BE2 1.88679
26 3ICR FAD 1.88679
27 3ICS FAD 1.88679
28 3KB6 NAD 1.88679
29 2C7G ODP 1.88679
30 5M67 3D1 1.88679
31 6ER9 NAP 1.88679
32 5M67 NAD 1.88679
33 5M67 ADE 1.88679
34 3AYI FAD 1.88679
35 3AYI HCI 1.88679
36 1X14 NAD 1.88679
37 3CTY FAD 1.88679
38 1F3L SAH 1.88679
39 1GR0 NAD 1.88679
40 5K0A FAD 1.88679
41 2PHX MAN MAN 1.98413
42 1TL2 NDG 2.11864
43 4UTW RFW 2.18341
44 3LST SAH 2.26415
45 1EBF NAD 2.26415
46 5UR0 NAD 2.26415
47 1Y8Q ATP 2.26415
48 5Y77 FAD 2.26415
49 2Y6Q I7T 2.26415
50 5MZI FYK 2.26415
51 5MZI FAD 2.26415
52 5JY6 NAD 2.26415
53 3UOY FAD 2.26415
54 3UOY NAP 2.26415
55 3GWZ SAH 2.26415
56 3ZF8 GDP 2.26415
57 3QJ4 FAD 2.26415
58 1SAY PYR 2.26415
59 4J36 1HR 2.26415
60 2Y6Q FAD 2.26415
61 4J36 FAD 2.26415
62 4K5S PM0 2.26415
63 4K5S FAD 2.26415
64 3NTA FAD 2.26415
65 6GKV SAH 2.26415
66 1KYZ SAH 2.26415
67 4W6Z 8ID 2.26415
68 1BZL GCG 2.26415
69 1QMG DMV 2.26415
70 1BZL FAD 2.26415
71 3TLJ SAH 2.26415
72 3UCL NAP 2.26415
73 5O96 SAM 2.44898
74 1H82 GZZ 2.64151
75 1C0I FAD 2.64151
76 1C0I BE2 2.64151
77 1H82 FAD 2.64151
78 2CVZ NDP 2.64151
79 3WLE NAD 2.64151
80 1E3I CXF 2.64151
81 1ZK7 FAD 2.64151
82 1D4D FAD 2.64151
83 5U8U FAD 2.64151
84 4GK9 MAN BMA MAN MAN MAN 2.64151
85 1YJQ NAP 2.64151
86 4XYB NDP 2.64151
87 4YNU LGC 2.64151
88 4YNU FAD 2.64151
89 3G89 SAM 2.81124
90 5EES NAP 2.83401
91 2DC1 NAD 2.9661
92 5E5U MLI 3.01508
93 4LHD GLY 3.01887
94 5JJR SAH 3.01887
95 6AIN FAD 3.01887
96 1LVL NAD 3.01887
97 1H2B NAJ 3.01887
98 3T7S SAM 3.01887
99 1YY5 FAD 3.01887
100 5W7M SAH 3.01887
101 3A25 SAM 3.01887
102 4DSG FAD 3.01887
103 4DSG UDP 3.01887
104 1NPD NAD 3.01887
105 4AP3 NAP 3.01887
106 4AP3 FAD 3.01887
107 2PUL ACP 3.01887
108 2VTD LKM 3.01887
109 1VI2 NAD 3.01887
110 5JGL SAM 3.01887
111 1V59 FAD 3.01887
112 3OND NAD 3.01887
113 3OND ADN 3.01887
114 4BVA NDP 3.01887
115 2RGJ FAD 3.01887
116 1J49 NAD 3.01887
117 4D04 FAD 3.01887
118 4D04 NAP 3.01887
119 1J5P NAD 3.16206
120 3GU3 SAH 3.16901
121 1VBO MAN MAN MAN 3.3557
122 1I8T FAD 3.39623
123 6GAS FAD 3.39623
124 5AYV NAP 3.39623
125 5X68 FAD 3.39623
126 3GF4 UPG 3.39623
127 5I39 FAD 3.39623
128 1G55 SAH 3.39623
129 3SQP FAD 3.39623
130 3GF4 FAD 3.39623
131 3PLN U5P 3.39623
132 3FPZ AHZ 3.39623
133 2B5W NAP 3.39623
134 1HKU NAD 3.39623
135 1D1T NAD 3.39623
136 2PT9 2MH 3.39623
137 1KNR FAD 3.39623
138 5AJP UDP 3.39623
139 1V8B NAD 3.39623
140 4A6D SAM 3.39623
141 2I7C AAT 3.53357
142 4FGC PQ0 3.63636
143 5Y02 MXN 3.73832
144 4YMH SAH 3.75
145 2CDU ADP 3.77358
146 3BAZ NAP 3.77358
147 1JG3 ADN 3.77358
148 3HAD NAD 3.77358
149 3E1T FAD 3.77358
150 4MO2 FDA 3.77358
151 2JHF NAD 3.77358
152 4MO2 FAD 3.77358
153 2NPX FAD 3.77358
154 2NPX NAD 3.77358
155 2CDU FAD 3.77358
156 5JWC FAD 3.77358
157 1U3U BNF 3.77358
158 1U3U NAD 3.77358
159 5KMS FAD 3.77358
160 2JB2 PHE 3.77358
161 2JB2 FAD 3.77358
162 5X20 NAD 3.77358
163 3G5S FAD 3.77358
164 3ULK NDP 3.77358
165 2FZW NAD 3.77358
166 4CNE SAH 3.77358
167 1C3V NDP 3.77358
168 4RDI ATP 3.81944
169 2QBU SAH 3.87931
170 3AB4 THR 3.93258
171 2DTJ THR 3.93258
172 5H81 NAP 4.11311
173 3WV8 ATP 4.12844
174 1FP2 SAH 4.15094
175 5MPT SAH 4.15094
176 5CAE COA 4.15094
177 5CUQ NSC 4.15094
178 5N6C NAD 4.15094
179 1DJN ADP 4.15094
180 2WET FAD 4.15094
181 1RJW ETF 4.15094
182 5KVS NAP 4.15094
183 4HNN LYS 4.15094
184 5BW4 SAM 4.15094
185 3ZNN FAD 4.15094
186 3ZNN 4WL 4.15094
187 3VSE SAH 4.15094
188 5CAE SIN 4.15094
189 1PL6 572 4.15094
190 1XHC FAD 4.15094
191 2PX8 SAH 4.15094
192 1GQ2 NAP 4.15094
193 1PL6 NAD 4.15094
194 1OMO NAD 4.15094
195 3BXO SAM 4.1841
196 3EGI ADP 4.36893
197 2VDV SAM 4.47154
198 5WP4 SAH 4.5283
199 1ZGA SAH 4.5283
200 1H5S TMP 4.5283
201 2VHW NAI 4.5283
202 2ZJ1 ARJ 4.5283
203 2ZJ1 NAD 4.5283
204 4X9M FAD 4.5283
205 3FSY SCA 4.5283
206 1REO FAD 4.5283
207 3EF0 ALF 4.5283
208 2ZXI FAD 4.5283
209 2IID PHE 4.5283
210 2IID FAD 4.5283
211 5TTJ FAD 4.5283
212 1U8X NAD 4.5283
213 2X1L ADN 4.5283
214 5TS5 FAD 4.5283
215 6FP4 FAD 4.5283
216 4YRY FAD 4.5283
217 5N0J FAD 4.5283
218 3WUR O4B 4.67836
219 3LCC SAH 4.68085
220 4DE3 DN8 4.90566
221 3LZW FAD 4.90566
222 3FUU ADN 4.90566
223 3LZW NAP 4.90566
224 1YQZ FAD 4.90566
225 4DDY DN6 4.90566
226 3AXB FAD 4.90566
227 3AXB PRO 4.90566
228 1SQF SAM 4.90566
229 2VYN NAD 4.90566
230 6BT6 3GK 4.90566
231 5W7K SAH 4.90566
232 5K7U SAM 4.90566
233 3AB1 FAD 4.90566
234 1RZM E4P 4.90566
235 2O4C NAD 4.90566
236 4U8P FDA 4.90566
237 4II2 ATP 4.90798
238 1EJ0 SAM 5
239 1KJ8 GAR 5.28302
240 5THY SAH 5.28302
241 4RPL 3UC 5.28302
242 4RPL FAD 5.28302
243 5HSA FAS 5.28302
244 1DLJ NAI 5.28302
245 1DLJ UGA 5.28302
246 5THZ SAH 5.28302
247 2HIM ASN 5.28302
248 5MBX SP5 5.28302
249 5MBX FAD 5.28302
250 3X01 AMP 5.28302
251 3DUW SAH 5.38117
252 4PNE SAH 5.62914
253 5HW4 SAM 5.64516
254 1FP1 SAH 5.66038
255 4XB2 HSE 5.66038
256 5LOG SAH 5.66038
257 4CJX NAP 5.66038
258 6ECW SAH 5.66038
259 2IXB A2G 5.66038
260 5TUK FAD 5.66038
261 3S5W FAD 5.66038
262 2IXB NAD 5.66038
263 1ONX ASP 5.66038
264 3JQM GTP 5.73248
265 4YUW 4JU 5.92105
266 4YUW S4M 5.92105
267 3A4T SFG 6.03774
268 4R5M NAP 6.03774
269 4UCI SAM 6.03774
270 2NU8 COA 6.03774
271 2VVM FAD 6.03774
272 2VVL FAD 6.03774
273 5Z21 NAI 6.03774
274 5Z20 NAI 6.03774
275 1RSG FAD 6.03774
276 4UP3 NDP 6.03774
277 6GAR FAD 6.03774
278 4R5M 4NO 6.03774
279 3NYC IAR 6.03774
280 3NYC FAD 6.03774
281 1XDS SAM 6.03774
282 1OBB NAD 6.03774
283 4DCM SAM 6.03774
284 6A3J NAI 6.03774
285 4NEC SAH 6.06061
286 4ZCC FAD 6.25
287 4ZCC NAI 6.25
288 1UW1 ADP 6.25
289 4RQU NAD 6.41509
290 2QA1 FAD 6.41509
291 3NTD FAD 6.41509
292 4EIP FAD 6.41509
293 5WP5 SAH 6.79245
294 5WKC F50 6.79245
295 2WPB ZZI 6.79245
296 4E5N NAD 6.79245
297 4KRI SAH 6.79245
298 5W7R SAH 6.79245
299 4BWL MN9 6.79245
300 3KO0 TFP 6.93069
301 2DKH 3HB 7.16981
302 5KOK SAH 7.16981
303 3IHG FAD 7.16981
304 3HDY FAD 7.16981
305 2GAG FAD 7.16981
306 2GAG FOA 7.16981
307 3HDY GDU 7.16981
308 3HDY FDA 7.16981
309 1L7E NAI 7.16981
310 5A0U CHT 7.16981
311 5VN0 FAD 7.16981
312 5N5D SAM 7.52212
313 5U5N NAD 7.52688
314 1YKJ PHB 7.54717
315 1YKJ FAD 7.54717
316 1JNR FAD 7.54717
317 3NJ4 AFX 7.54717
318 3NJ4 NAD 7.54717
319 6FDF SAH 7.54717
320 1KEV NDP 7.54717
321 2GSD NAD 7.54717
322 2EV9 NAP 7.60456
323 2EV9 SKM 7.60456
324 2E5V FAD 7.92453
325 1RM4 NDP 7.92453
326 6C4M NAP 7.92453
327 1BXG NAD 7.92453
328 5MW4 5JU 7.92453
329 5ZW3 SAH 8
330 5BSZ SAH 8
331 3IWD M2T 8.06452
332 4QTU SAM 8.14815
333 4XZ3 COA 8.26087
334 3L9W GSH 8.30189
335 1C1X NAD 8.30189
336 4RHE FMN 8.30189
337 3KIF GDL 8.49057
338 1KYQ NAD 8.67924
339 1TE2 PGA 8.67924
340 5AOV NAP 8.67924
341 3TKY SAH 8.67924
342 4FWE FAD 8.67924
343 2EG5 SAH 8.67924
344 2HNK SAH 8.78661
345 3GFB NAD 9.0566
346 3CMC NAD 9.0566
347 5BUK FAD 9.0566
348 3AD8 FAD 9.0566
349 3AD8 PYC 9.0566
350 1GET NAP 9.0566
351 5WGR FAD 9.0566
352 3MQ2 SAH 9.17431
353 3OZG SSI 9.2
354 2D2I NAP 9.21053
355 2DFV NAD 9.43396
356 5OC1 FAD 9.43396
357 1TZD ADP 9.43396
358 2Q7V FAD 9.43396
359 1P31 EPU 9.43396
360 5Y8L HUI 9.43396
361 5Y8L NAD 9.43396
362 3WGT FAD 9.81132
363 3WGT QSC 9.81132
364 3NKS FAD 9.81132
365 4CNK FAD 9.81132
366 2DBZ NAP 9.81132
367 5N2I NAP 9.91379
368 4JK3 NAD 10.0386
369 4J4H 1J1 10.0386
370 4J4H NAI 10.0386
371 6BII NAP 10.1887
372 2E0N SAH 10.1887
373 1LUA NAP 10.1887
374 1O94 ADP 10.2273
375 3B20 NAD 10.3245
376 3B1J NAD 10.3245
377 5LW0 AR6 10.3896
378 4GUT FAD 10.4839
379 4HSU FAD 10.4839
380 4GUS FAD 10.4839
381 3LKZ SFG 10.566
382 5TWB FAD 10.566
383 5JCA FAD 10.566
384 5JCA NDP 10.566
385 5XHA FRU 10.566
386 5TVI O8N 10.8696
387 6D6Y SAH 10.9434
388 2HYV UAP SGN IDS SGN IDS 10.9434
389 2YVJ NAI 11.3208
390 2Q0L NAP 11.3208
391 2AQJ FAD 11.3208
392 2AQJ TRP 11.3208
393 1Q3Q ANP 11.6981
394 5O9F NAD 12.0755
395 5O9F 9ON 12.0755
396 2F5Z FAD 12.0755
397 5J5Z FAD 12.0755
398 3RNM FAD 12.0755
399 4YCA NDP 12.8302
400 3OJO NAD 13.2075
401 4Y8D 49J 13.5714
402 2ZWA SAH 13.5849
403 4TXI FAD 13.9623
404 2BRY FAD 13.9623
405 1E1M FAD 14.3396
406 1E1M NAP 14.3396
407 1E6E FAD 14.3396
408 4JDR FAD 15.0943
409 1HTW ADP 15.1899
410 3RUV ANP 15.4717
411 5HXI FAD 15.4717
412 5HXI 5HN 15.4717
413 2RGO FAD 15.8491
414 3TWO NDP 16.6038
415 1PNO NAP 16.6667
416 2Z3Y F2N 16.9811
417 2R4J FAD 16.9811
418 2R4J 13P 16.9811
419 4KIB SAH 17.3585
420 5DN9 NAD 17.7358
421 3ZVS MLI 23.75
422 5FA5 MTA 25
423 5EPO TUD 47.3282
Pocket No.: 3; Query (leader) PDB : 1H5Q; Ligand: NAP; Similar sites found with APoc: 69
This union binding pocket(no: 3) in the query (biounit: 1h5q.bio1) has 32 residues
No: Leader PDB Ligand Sequence Similarity
1 3KIH GDL None
2 1XXA ARG None
3 4OBW SAM 1.16732
4 1M7G AV2 1.4218
5 2WHP HI6 1.50943
6 1SW1 PBE 1.88679
7 1KOL NAD 1.88679
8 1DRV A3D 1.88679
9 1QAN SAH 2.04918
10 5H4S RAM 2.26415
11 3WBF NAP 2.26415
12 2WK1 SAH 2.26415
13 5LVP ATP 2.64151
14 1X7D NAD 2.64151
15 4IDT T28 2.80899
16 4YRD 3IT 3.01887
17 5TDF 7A3 3.01887
18 1ZH8 NAP 3.01887
19 6FHO FAD 3.01887
20 3W68 PBU 3.01887
21 6C5B SAH 3.01887
22 4BFM ANP 3.01887
23 4U60 SIA 3.01887
24 3GDH SAH 3.73444
25 2RG0 CBI 3.77358
26 2RFY CBI 3.77358
27 3QOX SAH 3.77358
28 4IRP UDP 3.98406
29 5F8F SFG 4.15094
30 2WEL K88 4.66667
31 2D5X L35 4.79452
32 1CDO NAD 4.90566
33 5IL1 SAM 4.90566
34 1YB5 NAP 5.28302
35 5ZI9 FLC 5.66038
36 6BQ6 TER 5.66038
37 3CF6 SP1 5.66038
38 2GLX NDP 6.03774
39 1W8S FBP 6.08365
40 1FEC FAD 6.41509
41 2FYF PLP 6.78392
42 3AXM 6PG 6.97674
43 3MMH SME 7.18563
44 1S8G DAO 7.43802
45 4FXQ G9L 7.54717
46 2VN9 GVD 7.6412
47 5YRJ BGC GLC 7.74648
48 5HWK BEZ 7.91667
49 1O8B ABF 8.21918
50 1RYI GOA 8.30189
51 1RYI FAD 8.30189
52 4MP8 MLI 8.67924
53 4MP8 NAD 8.67924
54 5ME4 HP4 8.67924
55 2RAB NAD 8.67924
56 2RAB FAD 8.67924
57 5EIN NAP 9.25926
58 5L8L ADP 10.2564
59 4NTX AMR 11.6667
60 5YU3 PRO 11.6981
61