Receptor
PDB id Resolution Class Description Source Keywords
1Z6Z 2.5 Å EC: 1.1.1.153 CRYSTAL STRUCTURE OF HUMAN SEPIAPTERIN REDUCTASE IN COMPLEX HOMO SAPIENS SHORT-CHAIN DEHYDROGENASE/REDUCTASE SEPIAPTERIN REDUCTASE STRUCTURAL GENOMICS STRUCTURAL GENOMICS CONSORTIUM SGC OXIDOREDUCTASE
Ref.: CRYSTAL STRUCTURE OF HUMAN SEPIAPTERIN REDUCTASE TO BE PUBLISHED
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
CL A:401;
A:407;
B:408;
C:402;
C:405;
C:406;
D:403;
D:409;
E:404;
E:410;
F:411;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
35.453 Cl [Cl-]
NAP A:801;
B:802;
C:803;
D:804;
E:805;
F:806;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
none;
none;
submit data
743.405 C21 H28 N7 O17 P3 c1cc(...
SO4 A:301;
Invalid;
none;
submit data
96.063 O4 S [O-]S...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1Z6Z 2.5 Å EC: 1.1.1.153 CRYSTAL STRUCTURE OF HUMAN SEPIAPTERIN REDUCTASE IN COMPLEX HOMO SAPIENS SHORT-CHAIN DEHYDROGENASE/REDUCTASE SEPIAPTERIN REDUCTASE STRUCTURAL GENOMICS STRUCTURAL GENOMICS CONSORTIUM SGC OXIDOREDUCTASE
Ref.: CRYSTAL STRUCTURE OF HUMAN SEPIAPTERIN REDUCTASE TO BE PUBLISHED
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 4 families.
1 1Z6Z - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
70% Homology Family (8)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1SEP - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
2 1NAS - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
3 1OAA - OAA C4 H3 O5 C(C(=O)C(=....
4 4HWK ic50 = 82 nM SFY C11 H11 N3 O2 S c1ccnc(c1)....
5 4Z3K ic50 = 0.15 uM 4KL C10 H7 N O4 c1cc2c(cc(....
6 4XWY ic50 = 54 nM 43O C14 H18 N2 O3 Cc1c(c2cc(....
7 4J7U Ki = 14 nM YTZ C9 H9 N3 O2 S2 c1cc(ccc1N....
8 1Z6Z - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
50% Homology Family (8)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1SEP - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
2 1NAS - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
3 1OAA - OAA C4 H3 O5 C(C(=O)C(=....
4 4HWK ic50 = 82 nM SFY C11 H11 N3 O2 S c1ccnc(c1)....
5 4Z3K ic50 = 0.15 uM 4KL C10 H7 N O4 c1cc2c(cc(....
6 4XWY ic50 = 54 nM 43O C14 H18 N2 O3 Cc1c(c2cc(....
7 4J7U Ki = 14 nM YTZ C9 H9 N3 O2 S2 c1cc(ccc1N....
8 1Z6Z - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: NAP; Similar ligands found: 127
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 NAD IBO 0.688 0.921053
10 NHD 0.68254 0.958904
11 NJP 0.661417 0.972973
12 NAJ PYZ 0.659091 0.898734
13 NFD 0.658915 0.934211
14 DND 0.619048 0.959459
15 NXX 0.619048 0.959459
16 ZID 0.605839 0.972603
17 NAQ 0.59854 0.922078
18 ATR 0.59292 0.917808
19 NAE 0.591241 0.946667
20 NDE 0.58042 0.986301
21 A22 0.571429 0.958904
22 AMP NAD 0.571429 0.933333
23 NAJ 0.567164 0.986111
24 A2R 0.563025 0.932432
25 NDC 0.561644 0.922078
26 NA7 0.552846 0.907895
27 ODP 0.551471 0.935065
28 A2P 0.539823 0.930556
29 8ID 0.537313 0.910256
30 NAD BBN 0.525974 0.865854
31 NPW 0.525547 0.8875
32 CNA 0.521739 0.959459
33 NZQ 0.521739 0.910256
34 NAD CJ3 0.519231 0.835294
35 NDP 0.514493 0.922078
36 PO4 PO4 A A A A PO4 0.503937 0.930556
37 DG1 0.503401 0.922078
38 1DG 0.503401 0.922078
39 NAD TDB 0.5 0.696078
40 TXP 0.5 0.922078
41 NMN AMP PO4 0.492958 0.921053
42 XNP 0.492958 0.875
43 25L 0.492308 0.958904
44 25A 0.492063 0.972222
45 NAD NDT 0.490909 0.747368
46 NMN 0.486726 0.888889
47 NGD 0.485714 0.935065
48 2AM 0.477876 0.891892
49 ADP 0.458333 0.945205
50 PAP 0.451613 0.931507
51 ADP MG 0.45082 0.906667
52 BEF ADP 0.447154 0.883117
53 ADP BEF 0.447154 0.883117
54 A2D 0.445378 0.945205
55 AN2 0.442623 0.932432
56 ADP PO3 0.44 0.944444
57 SAP 0.44 0.896104
58 AGS 0.44 0.896104
59 M33 0.439024 0.906667
60 AR6 AR6 0.438849 0.945205
61 BA3 0.438017 0.945205
62 ATP MG 0.436508 0.906667
63 ADP BMA 0.43609 0.92
64 OAD 0.43609 0.92
65 ATP 0.435484 0.945205
66 OOB 0.435115 0.958904
67 B4P 0.434426 0.945205
68 AP5 0.434426 0.945205
69 GAP 0.433071 0.92
70 0WD 0.432432 0.922078
71 5FA 0.432 0.945205
72 2A5 0.432 0.87013
73 AQP 0.432 0.945205
74 00A 0.428571 0.909091
75 CA0 0.427419 0.92
76 ALF ADP 0.426357 0.871795
77 ADP ALF 0.426357 0.871795
78 ACP 0.424 0.92
79 NAJ PZO 0.423841 0.897436
80 9SN 0.423358 0.897436
81 VO4 ADP 0.423077 0.932432
82 ANP MG 0.423077 0.896104
83 ADP VO4 0.423077 0.932432
84 WAQ 0.422222 0.884615
85 ACQ 0.421875 0.92
86 V3L 0.421875 0.945205
87 ADQ 0.421053 0.92
88 AR6 0.420635 0.918919
89 APR 0.420635 0.918919
90 ATP A A A 0.42029 0.958333
91 CO7 0.419753 0.786517
92 1ZZ 0.419118 0.841463
93 3OD 0.419118 0.92
94 DLL 0.41791 0.958904
95 AD9 0.417323 0.92
96 NAX 0.416667 0.875
97 OVE 0.416667 0.857143
98 MYR AMP 0.416058 0.841463
99 AV2 0.415385 0.868421
100 A3P 0.414634 0.944444
101 NNR 0.414414 0.72973
102 ALF ADP 3PG 0.413793 0.8625
103 OMR 0.413793 0.831325
104 LA8 ALF 3PG 0.413793 0.8625
105 ANP 0.410853 0.92
106 A1R 0.410448 0.860759
107 ABM 0.409836 0.893333
108 AMP 0.408333 0.944444
109 A 0.408333 0.944444
110 SON 0.408 0.933333
111 PPS 0.407692 0.829268
112 5AL 0.407692 0.932432
113 TYR AMP 0.407143 0.933333
114 NAI 0.406897 0.909091
115 7D3 0.406504 0.857143
116 DAL AMP 0.406015 0.932432
117 ADX 0.404762 0.829268
118 ATF 0.40458 0.907895
119 3UK 0.404412 0.945946
120 AMP DBH 0.404255 0.894737
121 139 0.402685 0.875
122 AMP MG 0.401639 0.893333
123 50T 0.401575 0.906667
124 SRP 0.401515 0.907895
125 A A 0.40146 0.972222
126 FA5 0.4 0.933333
127 3AM 0.4 0.90411
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1Z6Z; Ligand: NAP; Similar sites found: 380
This union binding pocket(no: 1) in the query (biounit: 1z6z.bio2) has 31 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4EKV BTN 0.01005 0.42293 None
2 1E7S NAP 0.000002144 0.52428 1.06383
3 4OHU NAD 0.0000001895 0.44058 1.06383
4 4OHU 2TK 0.0000001895 0.44058 1.06383
5 2FR1 NDP 0.000001334 0.51416 1.41844
6 3BXO SAM 0.01715 0.40781 1.67364
7 1GY8 NAD 0.000001613 0.51827 1.77305
8 4PVD NDP 0.000002261 0.50816 1.77305
9 1Y1P NMN AMP PO4 0.00003349 0.50046 1.77305
10 2Q1W NAD 0.000004031 0.49768 1.77305
11 2HJR APR 0.0007245 0.44467 1.77305
12 3SSO SAH 0.001303 0.44108 1.77305
13 1X87 NAD 0.001914 0.42702 1.77305
14 3B20 NAD 0.00562 0.40187 1.77305
15 1FK8 NAD 0.00000000008574 0.71689 1.94553
16 1VBO MAN MAN MAN 0.0339 0.40793 2.01342
17 2BH9 NAP 0.0002906 0.48798 2.12766
18 4OOE NDP 0.0005423 0.43948 2.12766
19 1B8U NAD 0.001975 0.43323 2.12766
20 1LDN NAD 0.002262 0.40811 2.12766
21 3H9E NAD 0.003572 0.40704 2.12766
22 4KRG SAH 0.01363 0.40581 2.12766
23 3ITJ CIT 0.03395 0.40338 2.12766
24 1VKO NAD 0.00199 0.40146 2.12766
25 2G5C NAD 0.001371 0.42056 2.13523
26 3F81 STT 0.01484 0.41977 2.18579
27 3A27 SAM 0.003295 0.43058 2.20588
28 3WV8 ATP 0.003172 0.42773 2.29358
29 3MB5 SAM 0.007299 0.40269 2.35294
30 3ORF NAD 0.000000749 0.54253 2.39044
31 5L4L NAP 0.0002569 0.45962 2.48227
32 2VUT NAD 0.001461 0.43893 2.48227
33 1V59 NAD 0.006035 0.43388 2.48227
34 1DNP MHF 0.01631 0.43061 2.48227
35 4N9Z V3L 0.0204 0.42583 2.48227
36 1HDG NAD 0.002531 0.41586 2.48227
37 1UDB NAD 0.000004934 0.41543 2.48227
38 4AZT SAM 0.01103 0.4068 2.48227
39 4AZW SAM 0.009769 0.40605 2.48227
40 1Y8Q ATP 0.005805 0.40403 2.48227
41 5DN9 NAD 0.001596 0.40145 2.48227
42 2F1K NAP 0.001194 0.4259 2.50896
43 4GC1 MAN MAN 0.02168 0.4151 2.53623
44 4EUE NAI 0.00000005862 0.56253 2.83688
45 4ZRN NAD 0.0000004972 0.5158 2.83688
46 2PZM NAD 0.000058 0.48487 2.83688
47 2PZM UDP 0.000058 0.48487 2.83688
48 5JAQ NAI 0.00000126 0.47999 2.83688
49 1YS4 NAP 0.0004208 0.45838 2.83688
50 2C5A GDC 0.0000005165 0.43461 2.83688
51 2C5A NAD 0.0000005165 0.43461 2.83688
52 2I3G NAP 0.0003577 0.43272 2.83688
53 4ZRN UPG 0.000001724 0.43248 2.83688
54 2HYV UAP SGN IDS SGN IDS 0.01472 0.43011 2.83688
55 5FA5 MTA 0.006817 0.42338 2.83688
56 4D79 ATP 0.004983 0.42245 2.83688
57 4DMG SAM 0.01097 0.42105 2.83688
58 5CG1 NAD BBN 0.0000005353 0.41634 2.83688
59 4BHL ARG 0.02233 0.4145 2.83688
60 4DPL NAP 0.001501 0.41346 2.83688
61 2JJQ SAH 0.01327 0.41322 2.83688
62 2GZ3 NAP 0.0009155 0.4059 2.83688
63 4ZGS NAD 0.001344 0.40036 2.83688
64 2VDV SAM 0.003181 0.44319 2.84553
65 1ORR NAD 0.000000627 0.52024 2.88184
66 1P77 ATR 0.03308 0.40836 2.94118
67 1NYT NAP 0.003759 0.40892 2.95203
68 5BW4 SAM 0.01256 0.40746 2.99625
69 1QG6 NAD 0.00000001691 0.51259 3.06513
70 1QG6 TCL 0.00000001691 0.51259 3.06513
71 1HDO NAP 0.00001423 0.46904 3.19149
72 2DC1 NAD 0.001102 0.42426 3.19149
73 3B1F NAD 0.005154 0.41201 3.19149
74 2GCG NDP 0.003594 0.40167 3.19149
75 3G2O SAM 0.01433 0.40164 3.19149
76 3CBG SAH 0.01084 0.41043 3.44828
77 5JGL SAM 0.01202 0.40205 3.46021
78 3LU1 NAD 0.0000003057 0.55234 3.5461
79 1V6A TRE 0.000464 0.50984 3.5461
80 4RDH AMP 0.007075 0.42262 3.5461
81 2NAD NAD 0.002445 0.41187 3.5461
82 1X7D NAD 0.002018 0.41127 3.5461
83 4RDI ATP 0.01123 0.40646 3.5461
84 2CDU ADP 0.01469 0.40429 3.5461
85 3TTN SPD 0.04837 0.40005 3.5461
86 4GLL NAD 0.000001393 0.5314 3.56083
87 3FUU ADN 0.01023 0.40515 3.69004
88 2V6G NAP 0.0000003754 0.54179 3.90071
89 2UYQ SAM 0.004885 0.45518 3.90071
90 4MDH NAD 0.001182 0.42307 3.90071
91 5MDH NAD 0.001542 0.41858 3.90071
92 3KB6 NAD 0.001639 0.41755 3.90071
93 1CER NAD 0.002254 0.41497 3.90071
94 1I0Z NAI 0.001604 0.41237 3.90071
95 3C3Y SAH 0.005344 0.41769 4.21941
96 2X6T NAP 0.00001351 0.49044 4.25532
97 1EQ2 NAP 0.0000145 0.48928 4.25532
98 5F5N NAD 0.00003946 0.48454 4.25532
99 1RPN NDP 0.000004752 0.47189 4.25532
100 2JL1 NAP 0.0002288 0.46964 4.25532
101 1E5Q NDP 0.0004094 0.43779 4.25532
102 1LTH NAD 0.001339 0.4302 4.25532
103 5LD5 NAD 0.003342 0.4169 4.25532
104 1ZGA SAH 0.01262 0.41428 4.25532
105 1BW9 NAD 0.005656 0.41029 4.25532
106 1C1X NAD 0.003759 0.40616 4.25532
107 4K28 NAD 0.005944 0.4036 4.25532
108 1GAD NAD 0.001748 0.40256 4.25532
109 3VYW SAM 0.01106 0.40069 4.25532
110 4XUB 43D 0.01339 0.42071 4.2735
111 5N2I NAP 0.004895 0.4161 4.31034
112 2DKN NAI 0.00000000001336 0.72421 4.60993
113 1EK6 NAI 0.000003194 0.41477 4.60993
114 1EK6 UPG 0.000006602 0.40188 4.60993
115 1I9G SAM 0.01088 0.401 4.64286
116 3A4T SFG 0.008867 0.40195 4.74453
117 5T9E NAP 0.001509 0.42188 4.79705
118 4II2 ATP 0.006255 0.41147 4.81928
119 4NEC SAH 0.004287 0.43289 4.92424
120 1A27 NAP 0.00000001234 0.60478 4.96454
121 3KO8 NAD 0.0000002496 0.5409 4.96454
122 1WVG APR 0.000002778 0.53513 4.96454
123 2PK3 A2R 0.00001455 0.53125 4.96454
124 4R1S NAP 0.00000261 0.53124 4.96454
125 5E9W SAH 0.0004148 0.4912 4.96454
126 5E8J SAH 0.0005155 0.48126 4.96454
127 3HB5 NAP 0.00000008177 0.47405 4.96454
128 4OJP MAL 0.04766 0.40481 4.96454
129 5JE8 NAD 0.004883 0.40433 4.96454
130 1DSS NAD 0.005808 0.40129 4.96454
131 1O5O U5P 0.02762 0.40112 4.96454
132 2PXX SAH 0.01087 0.40399 5.11628
133 5LOG SAH 0.01272 0.40094 5.15021
134 4JNJ BTN 0.01103 0.41711 5.21739
135 3RFV NAI 0.000002031 0.53067 5.24345
136 3RFV 15L 0.00006678 0.4755 5.24345
137 5UAV TFB 0.0006175 0.40921 5.2795
138 5UAV NDP 0.001391 0.40035 5.2795
139 1KEW TYD 0.00001466 0.51564 5.31915
140 1KEW NAD 0.00001614 0.51506 5.31915
141 2Q1S NAI 0.00001317 0.51039 5.31915
142 3A4V NAD 0.0000008519 0.49916 5.31915
143 3A4V PYR 0.0000008519 0.49916 5.31915
144 3OA2 NAD 0.001836 0.41285 5.31915
145 2J4D MHF 0.04125 0.40397 5.31915
146 2YX1 SFG 0.008216 0.4233 5.67376
147 1A5Z NAD 0.003658 0.41837 5.67376
148 4D3F NAP 0.004452 0.41472 5.67376
149 1EZ4 NAD 0.003646 0.40669 5.67376
150 5KKA 6V0 0.001631 0.40423 5.67376
151 3OFK SAH 0.004457 0.42828 6.02837
152 3ABI NAD 0.0006525 0.42708 6.02837
153 1VL0 NAI 0.000003929 0.49339 6.16438
154 5JNW 6LJ 0.01323 0.43418 6.28931
155 2Q46 NAP 0.0000002449 0.56111 6.32411
156 4U7W NDP 0.0000001782 0.5718 6.38298
157 4TQG NDP 0.0000002298 0.56217 6.38298
158 5IN4 6CK 0.0001096 0.53053 6.38298
159 5IN4 NAP 0.0001116 0.53053 6.38298
160 5IN4 GDP 0.0001225 0.52754 6.38298
161 3GU3 SAH 0.007845 0.43248 6.38298
162 1LJ8 NAD 0.009486 0.40069 6.38298
163 1EJ0 SAM 0.001497 0.44607 6.66667
164 1R6D DAU 0.00001181 0.52163 6.73759
165 1R6D NAD 0.00001255 0.52163 6.73759
166 1D7O NAD 0.00000125 0.48708 6.73759
167 2NVK NAP 0.02174 0.41816 6.73759
168 1ZQ9 SAM 0.008935 0.41096 6.73759
169 3LCC SAH 0.007627 0.41749 6.80851
170 2YY7 NAD 0.0000009985 0.53497 7.0922
171 1Z45 NAD 0.000001423 0.5272 7.0922
172 1V35 NAI 0.0000001027 0.50198 7.0922
173 2DBZ NAP 0.0006671 0.42355 7.0922
174 3BAZ NAP 0.002414 0.41668 7.0922
175 4DCM SAM 0.01061 0.41429 7.0922
176 3A25 SAM 0.007638 0.41405 7.0922
177 1KYQ NAD 0.01065 0.41077 7.0922
178 5HJM MTA 0.01171 0.40255 7.0922
179 3DGY 2GP 0.04496 0.40263 7.2165
180 4OBW SAM 0.01068 0.40744 7.393
181 2FOI JPA 0.02176 0.40998 7.43494
182 1BXK NAD 0.0000008101 0.54123 7.44681
183 3WMX NAD 0.000001581 0.53987 7.44681
184 1H9A NAP 0.00009728 0.43725 7.44681
185 1SB8 NAD 0.000002172 0.43494 7.44681
186 1SB8 UD2 0.000001756 0.42326 7.44681
187 1LDM NAD 0.001946 0.40921 7.44681
188 4W6Z 8ID 0.004439 0.40301 7.44681
189 1RJD SAM 0.007385 0.40833 7.48503
190 1H5Q NAP 0.000000006472 0.6066 7.54717
191 2HK9 ATR 0.003755 0.44865 7.63636
192 2HK9 NAP 0.0056 0.40193 7.63636
193 3MJE NDP 0.000000189 0.5602 7.80142
194 2C29 NAP 0.00001969 0.426 7.80142
195 2C29 DQH 0.00002215 0.42431 7.80142
196 1PL6 NAD 0.005315 0.41455 7.80142
197 3RDO BTN 0.01384 0.41233 7.84314
198 3QDK QDK 0.04122 0.40182 8.15603
199 2XYQ SAH 0.004304 0.42533 8.19672
200 2DFV NAD 0.004449 0.40065 8.35735
201 1M0S CIT 0.02939 0.4071 8.6758
202 1N5D NDP 0.00000000001542 0.70156 8.86525
203 1WMA NDP 0.0000000000418 0.57859 8.86525
204 1WMA AB3 0.0000000000418 0.57859 8.86525
205 4PIV NDP 0.00000597 0.50561 8.86525
206 1LVL NAD 0.007423 0.40823 8.86525
207 2IZ1 ATR 0.03982 0.4046 8.86525
208 2WYV NAD 0.000002047 0.52127 9.1954
209 5MSO NAP 0.00000049 0.56 9.21986
210 5L95 AMP 0.000311 0.4724 9.21986
211 3H8V ATP 0.0003941 0.47225 9.21986
212 4XZ3 COA 0.005668 0.40729 9.26724
213 3H4V DVP 0.0000008531 0.46742 9.57447
214 3H4V NAP 0.000002418 0.46101 9.57447
215 5F8F SFG 0.003396 0.43767 9.57447
216 3EGI ADP 0.01836 0.42209 9.57447
217 9LDT NAD 0.002442 0.40685 9.57447
218 9LDB NAD 0.002002 0.40478 9.57447
219 4QTU SAM 0.003493 0.42587 9.62963
220 2BKA NDP 0.000007004 0.50539 9.92908
221 1SQF SAM 0.001327 0.44844 9.92908
222 5KVS NAP 0.003369 0.41374 9.92908
223 1KYZ SAH 0.0132 0.40646 9.92908
224 3G89 SAM 0.006663 0.42769 10.0402
225 1ZBQ NAD 0.000000002182 0.61347 10.0917
226 3OIG NAD 0.00000001152 0.61808 10.1504
227 2BGM NAJ 0.00000004142 0.57007 10.6383
228 2EXX NAP 0.0003849 0.42024 10.6383
229 5THY SAH 0.008457 0.40576 10.6383
230 1XTT U5P 0.007417 0.42165 10.6481
231 4J1Q NDP 0.000001831 0.51522 11.3475
232 3GEG NAD 0.000000009685 0.62101 12.1457
233 4YEF 4CQ 0.04509 0.40391 12.3596
234 4NBT NAD 0.000000000116 0.68829 12.5
235 2DTX BMA 0.0000000006474 0.5794 12.5
236 4JLS 3ZE 0.01287 0.43232 12.5
237 4YMH SAH 0.005696 0.4072 12.5
238 4RF7 ARG 0.01944 0.42062 12.766
239 1LSS NAD 0.002633 0.42781 12.8571
240 4JP3 CIT 0.004885 0.43842 12.9707
241 1RKX NAD 0.0000003546 0.54262 13.1206
242 5MPT SAH 0.003778 0.42789 13.1206
243 2HMT NAI 0.0005471 0.45352 13.1944
244 1UAY ADN 0.00002568 0.54397 13.6364
245 4O1M NAD 0.00000004013 0.58551 14.1844
246 1O6Z NAD 0.001121 0.43337 15.2482
247 1J5P NAD 0.003351 0.40544 15.415
248 1W73 NAP 0.000000156 0.59159 15.5629
249 1W8D NAP 0.0000001736 0.58969 15.5629
250 4Q9N NAI 0.00000002114 0.58761 16.443
251 4HXY NDP 0.000000075 0.56765 17.5799
252 1GZ6 NAI 0.00000001757 0.59021 17.7305
253 1HYE NAP 0.0004278 0.45423 17.7305
254 3U4C NDP 0.00000002252 0.60075 17.7936
255 1W6U NAP 0.00000006938 0.60603 18.0851
256 3RFA SAM 0.0145 0.40456 18.0851
257 5LUB 3Y7 0.04962 0.40006 18.3206
258 4FC7 COA 0.00000003774 0.50958 19.1336
259 4FC7 NAP 0.00000003774 0.50958 19.1336
260 1UZN NAP 0.0000005637 0.47287 19.4332
261 3O26 NDP 0.000000000003503 0.73823 20.5674
262 5L53 NAP 0.000000005795 0.66533 21.9858
263 3RJ5 NAD 0.000000003048 0.56568 22.0472
264 2PD4 DCN 0.00000001254 0.56472 22.1818
265 2PD4 NAD 0.0000000135 0.56366 22.1818
266 2ZWA SAH 0.007825 0.40427 22.3404
267 3VZS NAP 0.0000001676 0.48349 23.3463
268 3VZS CAA 0.000001361 0.40397 23.3463
269 5L4S NAP 0.00000000005123 0.62286 23.4043
270 5L4S 6KX 0.00000000005123 0.62286 23.4043
271 5GT9 NAP 0.0000000008145 0.6397 26.9962
272 1U7T NAD 0.000000009294 0.62171 29.4326
273 1U7T TDT 0.00000001258 0.52697 29.4326
274 1G0N PHH 0.0000000005119 0.68144 30.1418
275 1G0N NDP 0.000000000362 0.68128 30.1418
276 1E6W NAD 0.000000002208 0.6329 30.1418
277 3QWI NAP 0.0000000007874 0.6304 30.1418
278 3QWI CUE 0.000000002437 0.54877 30.1418
279 4O0L NDP 0.000000003259 0.61738 30.5455
280 3OJF IMJ 0.000000009374 0.63172 30.8511
281 3OJF NDP 0.000000006904 0.62544 30.8511
282 4YAG NAI 0.00000004135 0.50629 30.8511
283 3AFN NAP 0.00000000006134 0.69944 31.0078
284 1JA9 NDP 0.0000000002004 0.67733 31.0219
285 1E3W NAD 0.000000001482 0.63942 31.2057
286 1MXH DHF 0.000002108 0.53465 31.5217
287 1MXH NAP 0.000003269 0.52723 31.5217
288 3V1U NAD 0.00000000788 0.63777 31.9149
289 4QED NAP 0.00000007728 0.57481 31.9149
290 2WD7 NAP 0.0000004839 0.54979 32.0896
291 1BDB NAD 0.000000000341 0.63406 32.2695
292 3ZV6 NAD 0.000000001071 0.5579 32.2695
293 3ZV6 4HB 0.000000001194 0.55039 32.2695
294 4NBW NAD 0.000000001746 0.62399 32.2957
295 4OSP NAP 0.0000000001382 0.68538 32.3194
296 1SNY NAP 0.00000000004297 0.67388 32.5843
297 1AE1 NAP 0.000000000004768 0.74177 32.6007
298 2AG5 NAD 0.00000000477 0.62032 32.9268
299 1ZK4 NAP 0.00000001654 0.5547 33.0677
300 4FN4 NAD 0.0000000009002 0.64756 34.252
301 5ITV NAI 0.000000001112 0.63456 34.3972
302 2RH4 EMO 0.000000003586 0.52315 34.657
303 5EPO NAP 0.00000001612 0.60042 34.7328
304 1XKQ NDP 0.0000000001025 0.65181 34.7518
305 4D42 NAP 0.00000001572 0.63555 34.7518
306 4D42 W0I 0.00000001572 0.63555 34.7518
307 2Q2V NAD 0.00000000005901 0.70008 34.902
308 1NFQ NAI 0.0000000002509 0.67362 35
309 4K26 NDP 0.000000000006386 0.71607 35.1064
310 4K26 SFF 0.00000000001945 0.62134 35.1064
311 1GEG NAD 0.0000000000993 0.68358 35.1562
312 2CFC NAD 0.0000000003525 0.66983 35.2
313 4NBU NAI 0.000000000316 0.65466 35.2
314 1EDO NAP 0.00000000002603 0.68294 35.2459
315 2WSB NAD 0.000000002537 0.65221 35.4331
316 3CH6 311 0.0000000001026 0.48906 35.461
317 3CH6 NAP 0.0000000001026 0.48906 35.461
318 3NUG NAD 0.000000005703 0.61978 35.6275
319 3SJ7 NDP 0.000000003724 0.63066 35.7143
320 1VL8 NAP 0.00000000004162 0.66632 35.8156
321 4ZA2 NAD 0.00000000001766 0.71956 35.9684
322 2ZAT NAP 0.0000000005144 0.65671 36.1538
323 1ZEM NAD 0.00000007432 0.59243 36.2595
324 1IY8 NAD 0.0000000003188 0.65424 36.3296
325 5THQ NDP 0.00000000008333 0.68645 36.3971
326 4CLO NAP 0.0000002777 0.5643 36.5248
327 4CME NAP 0.0000002219 0.56274 36.5248
328 5K6A NAP 0.0000001709 0.56184 36.5248
329 3JQ7 NAP 0.0000003549 0.56016 36.5248
330 4CM9 NAP 0.0000002061 0.55878 36.5248
331 3JQA NAP 0.0000004433 0.5564 36.5248
332 4CM8 NAP 0.0000003517 0.55509 36.5248
333 5JDC NAP 0.0000003576 0.55481 36.5248
334 3BMQ NAP 0.0000002776 0.55391 36.5248
335 3JQF NAP 0.0000002938 0.55299 36.5248
336 5JCJ NAP 0.0000004015 0.55289 36.5248
337 3JQ9 NAP 0.0000003123 0.55199 36.5248
338 4CLR NAP 0.0000004347 0.55157 36.5248
339 4CM4 NAP 0.0000004382 0.55144 36.5248
340 5JDI NAP 0.0000004603 0.55062 36.5248
341 3BMO NAP 0.0000004725 0.55019 36.5248
342 3JQ8 NAP 0.0000003594 0.5497 36.5248
343 3JQG NAP 0.0000006742 0.54931 36.5248
344 4CMI NAP 0.0000005549 0.54752 36.5248
345 3JQB NAP 0.0000007841 0.54676 36.5248
346 3BMN NAP 0.0000004704 0.5453 36.5248
347 3SJU NDP 0.000000002312 0.62321 36.5591
348 3RKR NAP 0.0000001179 0.67573 37.0229
349 4ITU NAI 0.0000000007829 0.62189 37.1747
350 4ITU 1HS 0.000000002344 0.54275 37.1747
351 3ICC NAP 0.000000000007522 0.70217 37.2549
352 1O5I NAD 0.0000006466 0.5911 37.3494
353 3TN7 NJP 0.00000000002821 0.69265 37.3541
354 5T2U NAP 0.00000000003379 0.66945 37.5
355 2JAP NDP 0.00000000004824 0.68398 37.6518
356 2AE2 NAP 0.00000000003579 0.72481 37.6923
357 2AE2 PTO 0.00000000003579 0.60805 37.6923
358 4CQM NAP 0.00000000255 0.63055 38.1148
359 3O03 NAP 0.0000001297 0.58286 38.2979
360 3A28 NAD 0.00000000009033 0.68513 38.7597
361 2JAH NDP 0.00000000009887 0.6727 38.8664
362 2EWM NAD 0.0000000006048 0.64422 38.9558
363 1XSE NDP 0.00000000002741 0.60885 39.0071
364 1YXM ADE 0.0000148 0.58679 39.3617
365 3AY6 NAI 0.000000008672 0.55895 39.777
366 3AY6 BGC 0.00000002955 0.48254 39.777
367 3OID NDP 0.000000003798 0.59914 39.9225
368 3OID TCL 0.0353 0.40684 39.9225
369 1XG5 NAP 0.000000000003698 0.7248 40.1434
370 1XHL NDP 0.0000000001149 0.6865 41.4894
371 3WXB NDP 0.000000000003185 0.72656 41.5771
372 1GEE NAD 0.0000000176 0.59898 41.7625
373 4KWI NAP 0.0000000003733 0.57512 42.2053
374 4KWI 1TJ 0.000000000419 0.56683 42.2053
375 2B4Q NAP 0.00000000003684 0.69978 42.3913
376 1X1T NAD 0.000000001158 0.61518 42.6923
377 2GDZ NAD 0.0000000000295 0.70341 45.3184
378 1Q7B NAP 0.00000008823 0.57264 46.3115
379 1PR9 NAP 0.000000000002142 0.75503 46.7213
380 3D3W NAP 0.000000000002352 0.70798 46.7213
Pocket No.: 2; Query (leader) PDB : 1Z6Z; Ligand: NAP; 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: 1z6z.bio2) has 31 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 1Z6Z; Ligand: NAP; Similar sites found: 12
This union binding pocket(no: 3) in the query (biounit: 1z6z.bio3) has 30 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4GGZ BTN 0.007592 0.42765 2.6087
2 4BG4 ARG 0.02409 0.41474 2.83688
3 1PS9 FAD 0.006663 0.40361 4.25532
4 3R75 PYR 0.03932 0.40108 4.25532
5 1VM6 NAD 0.00164 0.40333 4.82456
6 1WD4 AHR 0.02711 0.40772 5.31915
7 4TO8 FLC 0.04153 0.40056 6.16438
8 2PKA BEN 0.02794 0.41209 6.25
9 1DMH MCT 0.03141 0.40439 6.38298
10 4J36 1HR 0.008429 0.40135 6.38298
11 4J36 FAD 0.005286 0.40135 6.38298
12 1R37 NAD 0.004777 0.40192 13.1206
Pocket No.: 4; Query (leader) PDB : 1Z6Z; Ligand: NAP; 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: 1z6z.bio3) has 30 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 5; Query (leader) PDB : 1Z6Z; Ligand: NAP; 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: 1z6z.bio1) has 30 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 6; Query (leader) PDB : 1Z6Z; Ligand: NAP; Similar sites found: 2
This union binding pocket(no: 6) in the query (biounit: 1z6z.bio1) has 31 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1PZM 5GP 0.03985 0.40014 None
2 3EW2 BTN 0.01017 0.42676 2.96296
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