Receptor
PDB id Resolution Class Description Source Keywords
5IQD 2.2 Å EC: 2.3.1.-_2.7.1.- AMINOGLYCOSIDE PHOSPHOTRANSFERASE (2'')-IA (CTD OF AAC(6')- IE/APH(2'')-IA) IN COMPLEX WITH GMPPNP, MAGNESIUM, AND RIBO STAPHYLOCOCCUS AUREUS KINASE ANTIBIOTIC AMINOGLYCOSIDE RESISTANCE TRANSFERASE
Ref.: ANTIBIOTIC BINDING DRIVES CATALYTIC ACTIVATION OF AMINOGLYCOSIDE KINASE APH(2)-IA. STRUCTURE V. 24 935 2016
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
MG A:702;
C:700;
B:702;
C:702;
B:700;
A:700;
D:700;
D:702;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
24.305 Mg [Mg+2...
RIO B:600;
A:600;
C:600;
D:600;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
submit data
454.473 C17 H34 N4 O10 C1[C@...
GNP A:500;
B:500;
C:500;
D:500;
Valid;
Valid;
Valid;
Valid;
none;
Atoms found MORE than expected: % Diff = 1.281;
none;
Atoms found MORE than expected: % Diff = 1.281;
submit data
522.196 C10 H17 N6 O13 P3 c1nc2...
CL B:802;
A:802;
C:802;
Invalid;
Invalid;
Invalid;
none;
none;
none;
submit data
35.453 Cl [Cl-]
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
5IQD 2.2 Å EC: 2.3.1.-_2.7.1.- AMINOGLYCOSIDE PHOSPHOTRANSFERASE (2'')-IA (CTD OF AAC(6')- IE/APH(2'')-IA) IN COMPLEX WITH GMPPNP, MAGNESIUM, AND RIBO STAPHYLOCOCCUS AUREUS KINASE ANTIBIOTIC AMINOGLYCOSIDE RESISTANCE TRANSFERASE
Ref.: ANTIBIOTIC BINDING DRIVES CATALYTIC ACTIVATION OF AMINOGLYCOSIDE KINASE APH(2)-IA. STRUCTURE V. 24 935 2016
Members (11)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 5IQI - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
2 5IQE - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
3 5IQF - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
4 4ORK - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
5 5IQH - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
6 5IQG - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
7 5BYL - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
8 5IQA - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
9 5IQD - RIO C17 H34 N4 O10 C1[C@H]([C....
10 5IQB - KAN C18 H36 N4 O11 C1[C@H]([C....
11 5IQC - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
70% Homology Family (11)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 5IQI - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
2 5IQE - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
3 5IQF - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
4 4ORK - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
5 5IQH - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
6 5IQG - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
7 5BYL - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
8 5IQA - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
9 5IQD - RIO C17 H34 N4 O10 C1[C@H]([C....
10 5IQB - KAN C18 H36 N4 O11 C1[C@H]([C....
11 5IQC - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
50% Homology Family (13)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 3HAM - LLL C19 H39 N5 O7 C[C@@]1(CO....
2 3HAV - SRY C21 H39 N7 O12 [H]/N=C(/N....
3 5IQI - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
4 5IQE - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
5 5IQF - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
6 4ORK - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
7 5IQH - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
8 5IQG - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
9 5BYL - GCP C11 H18 N5 O13 P3 c1nc2c(n1[....
10 5IQA - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
11 5IQD - RIO C17 H34 N4 O10 C1[C@H]([C....
12 5IQB - KAN C18 H36 N4 O11 C1[C@H]([C....
13 5IQC - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: RIO; Similar ligands found: 8
No: Ligand ECFP6 Tc MDL keys Tc
1 RIO 1 1
2 NMY 0.784615 1
3 PAR 0.776119 1
4 B31 0.585366 0.90566
5 9CS 0.569444 0.958333
6 KNC 0.472973 0.9375
7 KAN 0.460526 0.958333
8 MYG 0.424242 0.791667
Ligand no: 2; Ligand: GNP; Similar ligands found: 128
No: Ligand ECFP6 Tc MDL keys Tc
1 GNP 1 1
2 GDP 0.839506 0.973684
3 GP3 0.82716 0.948718
4 GTP 0.809524 0.973684
5 GNH 0.807229 0.986842
6 G1R 0.77907 0.961039
7 GCP 0.77907 0.948718
8 GSP 0.770115 0.925
9 5GP 0.756098 0.960526
10 G 0.756098 0.960526
11 G2R 0.747253 0.936709
12 GMV 0.747126 0.948718
13 GAV 0.714286 0.936709
14 GP2 0.712644 0.936709
15 G2P 0.711111 0.936709
16 Y9Z 0.708333 0.880952
17 GDP MG 0.696629 0.9
18 GDD 0.690722 0.936709
19 GDC 0.690722 0.936709
20 GKE 0.690722 0.936709
21 GDP BEF 0.688889 0.878049
22 G5P 0.686869 0.948718
23 GPG 0.684211 0.936709
24 GTG 0.683673 0.91358
25 GFB 0.683673 0.936709
26 GDR 0.683673 0.936709
27 JB2 0.68 0.936709
28 GKD 0.68 0.936709
29 G3A 0.676768 0.948718
30 6CK 0.676768 0.91358
31 GDX 0.673267 0.948718
32 ALF 5GP 0.67033 0.86747
33 GTP MG 0.666667 0.9
34 BEF GDP 0.666667 0.86747
35 YGP 0.663265 0.879518
36 GCP G 0.659574 0.911392
37 GPD 0.656863 0.902439
38 GDP AF3 0.645833 0.86747
39 GDP ALF 0.645833 0.86747
40 JB3 0.641509 0.925
41 DBG 0.640351 0.974359
42 G3D 0.638298 0.960526
43 G4P 0.625 0.960526
44 GMP 0.621951 0.857143
45 NGD 0.62037 0.936709
46 GGM 0.618182 0.925926
47 0O2 0.616162 0.960526
48 G G 0.61 0.911392
49 2MD 0.603604 0.870588
50 CAG 0.60177 0.904762
51 U2G 0.590909 0.91358
52 FEG 0.590909 0.858824
53 GDP 7MG 0.590476 0.888889
54 MGD 0.587719 0.870588
55 ZGP 0.585586 0.848837
56 CG2 0.580357 0.91358
57 ANP 0.568421 0.922078
58 PGD 0.567797 0.902439
59 MD1 0.567797 0.870588
60 3GP 0.56044 0.922078
61 TPG 0.558333 0.822222
62 GH3 0.55 0.948052
63 FE9 0.546219 0.778947
64 GPX 0.539216 0.922078
65 G4M 0.539062 0.860465
66 DGI 0.536082 0.9
67 BGO 0.535088 0.901235
68 IDP 0.53125 0.947368
69 DGT 0.53 0.9
70 2GP 0.526882 0.935065
71 G1R G1R 0.520325 0.901235
72 I2C FE2 CMO CMO 0.516667 0.811111
73 U A G G 0.512605 0.911392
74 AGO 0.504202 0.91358
75 G A A A 0.504202 0.9
76 P2G 0.5 0.860759
77 G1G 0.5 0.902439
78 MGP 0.49505 0.936709
79 PGD O 0.492063 0.831461
80 6G0 0.490196 0.936709
81 P1G 0.489796 0.85
82 DGP 0.474227 0.8875
83 DG 0.474227 0.8875
84 G G U 0.473684 0.911392
85 IMP 0.463918 0.934211
86 G2Q 0.462963 0.936709
87 GPC 0.459677 0.858824
88 G C 0.459016 0.878049
89 GTA 0.448276 0.91358
90 G7M 0.444444 0.924051
91 MAP 0.439252 0.898734
92 G G G RPC 0.435484 0.853659
93 B4P 0.434343 0.871795
94 AP5 0.434343 0.871795
95 ADP 0.434343 0.896104
96 A2D 0.43299 0.871795
97 U G A 0.431655 0.86747
98 G G G C 0.426357 0.890244
99 SGP 0.425743 0.807229
100 AU1 0.425743 0.922078
101 BA3 0.424242 0.871795
102 35G 0.423077 0.909091
103 PCG 0.423077 0.909091
104 A G C C 0.423077 0.888889
105 C2E 0.423077 0.897436
106 APC G U 0.421875 0.864198
107 ATP 0.421569 0.896104
108 ACQ 0.419048 0.873418
109 5GP 5GP 0.419048 0.860759
110 AQP 0.417476 0.896104
111 5FA 0.417476 0.896104
112 01G 0.417391 0.880952
113 UNP 0.415842 0.810127
114 AN2 0.415842 0.909091
115 6AD 0.415094 0.821429
116 ITT 0.411765 0.846154
117 M33 0.411765 0.860759
118 G C C C 0.410448 0.901235
119 G U34 0.408 0.86747
120 ACP 0.407767 0.873418
121 APR 0.403846 0.871795
122 AR6 0.403846 0.871795
123 DG DG 0.403509 0.845238
124 A4P 0.403226 0.848837
125 UCG 0.402985 0.888889
126 AD9 0.4 0.873418
127 SAP 0.4 0.851852
128 AGS 0.4 0.851852
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 5IQD; Ligand: RIO; Similar sites found: 352
This union binding pocket(no: 1) in the query (biounit: 5iqd.bio2) has 37 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2VQD AP2 0.00691 0.41983 1.31148
2 4D52 GXL 0.04694 0.40255 1.63934
3 2WEI VGG 0.01294 0.42058 1.74216
4 1XJD STU 0.00001533 0.54574 1.96721
5 5MRH Q9Z 0.002475 0.47048 1.96721
6 5C1P ADP 0.004217 0.44889 1.96721
7 5C1P DAL DAL 0.01023 0.40082 1.96721
8 1K3A ACP 0.0006729 0.48898 2.00669
9 3ORQ ADP 0.01023 0.41209 2.12202
10 1TQP ATP 0.000003881 0.54998 2.12766
11 3BU5 ATP 0.00002033 0.54591 2.29508
12 5DMZ ADP 0.0003623 0.48697 2.29508
13 5AWM ANP 0.002196 0.46803 2.29508
14 5VCV 1N1 0.000426 0.46264 2.29508
15 4KBA 1QM 0.0006648 0.44411 2.29508
16 4Y85 499 0.006984 0.42998 2.29508
17 2PNC CLU 0.03913 0.41222 2.29508
18 3EKK GS2 0.001215 0.41202 2.29508
19 5W4W 9WG 0.003674 0.40619 2.29508
20 4YZN 4K5 0.00002479 0.52033 2.43902
21 3DLS ADP 0.000037 0.54575 2.62295
22 2WQN ADP 0.0007204 0.48749 2.62295
23 3TII ANP 0.004731 0.45085 2.62295
24 4LH7 1X8 0.01133 0.43245 2.62295
25 1PK8 ATP 0.006976 0.40784 2.62295
26 3PP0 03Q 0.007333 0.40427 2.62295
27 4L3L 5FI 0.00001291 0.50511 2.63158
28 3GGF GVD 0.0003993 0.49497 2.65781
29 4M6T SAM 0.01131 0.44484 2.73224
30 2AQX ATP 0.002398 0.43714 2.76817
31 5X8I SQZ 0.000003978 0.5793 2.95082
32 5MY8 RXZ 0.00002751 0.50898 2.95082
33 5MW8 ATP 0.0000673 0.50142 2.95082
34 2YW2 ATP 0.0005259 0.47054 2.95082
35 3AKK ADP 0.0007024 0.46903 2.95082
36 3ORK AGS 0.0003708 0.46148 2.95082
37 3ZGJ RMN 0.00465 0.46113 2.95082
38 5NCY 8TK 0.001004 0.43084 2.95082
39 3GC8 B45 0.003863 0.42793 2.95082
40 2JDR GLY ARG PRO ARG THR THR SER PHE ALA GLU 0.00001548 0.41679 2.95082
41 2JDR L20 0.00001548 0.41679 2.95082
42 4UAA 3GK 0.03864 0.40356 3.04183
43 4UA7 3GK 0.03891 0.4034 3.04183
44 4DE2 DN3 0.04597 0.40312 3.04183
45 4DDY DN6 0.04179 0.40177 3.04183
46 4DDS 0J7 0.04502 0.40006 3.04183
47 2XOC ADP 0.009553 0.41873 3.06513
48 3ZJX BOG 0.01004 0.44386 3.11419
49 3SRV S19 0.0000115 0.56396 3.2491
50 2OFV 242 0.00256 0.40267 3.2491
51 3TXO 07U 0.00002904 0.55092 3.27869
52 4XH0 ADP 0.0007699 0.50381 3.27869
53 2QK4 ATP 0.004516 0.45669 3.27869
54 3WVR AMP 0.002982 0.45202 3.27869
55 4PU5 ANP 0.001333 0.44487 3.27869
56 5GZ9 ANP 0.001454 0.44323 3.27869
57 3PN1 IVH 0.01159 0.43963 3.27869
58 3V4S ATP 0.002581 0.43572 3.27869
59 3ETH ATP 0.003746 0.42853 3.27869
60 4YZC STU 0.0005352 0.42475 3.27869
61 5DXT 5H5 0.007865 0.42052 3.27869
62 4F4P 0SB 0.00004384 0.40086 3.2967
63 2XVD AS6 0.003311 0.41307 3.31126
64 3K5I ADP 0.001424 0.45094 3.47395
65 1U59 STU 0.000002155 0.59184 3.48432
66 2YAK OSV 0.0000008534 0.55145 3.50877
67 5DZT AMP 0.0001499 0.54384 3.60656
68 3VOT ADP 0.0002796 0.51408 3.60656
69 1RE8 BD2 0.000004431 0.46506 3.60656
70 4CC6 L5Y 0.006273 0.44915 3.60656
71 4G17 0VN 0.00577 0.43789 3.60656
72 4EUU BX7 0.00156 0.43209 3.60656
73 5UIU 8CG 0.001096 0.42935 3.60656
74 3H9R TAK 0.03094 0.41235 3.60656
75 3IDB ANP 0.00008844 0.49625 3.72671
76 2Y6O 1N1 0.002606 0.43554 3.78007
77 2V7O DRN 0.000001404 0.64153 3.93443
78 1Q8Y ADE 0.00005166 0.55903 3.93443
79 2PVN P63 0.00001107 0.51196 3.93443
80 1Q8Y ADP 0.0003891 0.47646 3.93443
81 4WNK 453 0.0000716 0.47589 3.93443
82 4Y93 746 0.001201 0.44001 3.93443
83 1I9Z 2IP 0.02316 0.41023 3.93443
84 4XV1 904 0.001838 0.41271 4.10959
85 3VPC ADP 0.01205 0.40591 4.25532
86 2PYW ADP 0.00002611 0.52959 4.2623
87 5LVP ATP 0.0001321 0.52452 4.2623
88 2WU6 DKI 0.00002104 0.52343 4.2623
89 4FG8 ATP 0.00005961 0.51335 4.2623
90 1U5R ATP 0.0001785 0.50146 4.2623
91 4OAV ACP 0.0002899 0.49653 4.2623
92 5U6C 7YS 0.0001468 0.49104 4.2623
93 4IDT T28 0.0004196 0.4888 4.2623
94 1M0W ANP 0.001789 0.46293 4.2623
95 4QMN DB8 0.0002361 0.44025 4.2623
96 5T8O 76Z 0.002643 0.43877 4.2623
97 5HX8 66P 0.0002287 0.46655 4.30464
98 4FE2 ADP 0.01781 0.41729 4.31373
99 1BYG STU 0.0005032 0.49003 4.31655
100 4CQE CQE 0.001214 0.45029 4.31655
101 2VN9 GVD 0.0002419 0.5237 4.31894
102 4OH4 ANP 0.000027 0.54011 4.59016
103 3V8S 0HD 0.00005055 0.53303 4.59016
104 4K33 ACP 0.00003773 0.52767 4.59016
105 2ZV2 609 0.0002251 0.51893 4.59016
106 4IZY 1J2 0.0001002 0.50315 4.59016
107 5LPZ ADP 0.0003231 0.48932 4.59016
108 3PTG 932 0.001213 0.48681 4.59016
109 3IGO ANP 0.0002115 0.48401 4.59016
110 2VZ6 FEF 0.001396 0.47304 4.59016
111 3DNT ATP 0.0004932 0.45992 4.59016
112 3TPV ADE 0.002263 0.44555 4.59016
113 3TTI KBI 0.0007273 0.44253 4.59016
114 4ANW O92 0.000546 0.43529 4.59016
115 4PZ6 GMP 0.01877 0.4296 4.59016
116 5JGA 6KC 0.003533 0.40442 4.59016
117 5KO1 6UY 0.0003421 0.49307 4.59364
118 4USF 6UI 0.007564 0.43609 4.60526
119 1IA9 ANP 0.00357 0.4364 4.64286
120 4I94 ANP 0.0007272 0.47731 4.66667
121 5LPB ADP 0.009132 0.43611 4.72973
122 4LRJ ANP 0.00006133 0.52899 4.73373
123 5VC5 96M 0.0005368 0.44789 4.84429
124 5C03 AGS 0.00004014 0.532 4.91803
125 4UWH JXM 0.0001217 0.52033 4.91803
126 4WOV 3SM 0.0009143 0.48229 4.91803
127 4NW6 2NS 0.0001958 0.45222 4.91803
128 5TA6 79D 0.006339 0.40429 4.91803
129 1Y7P RIP 0.01019 0.43138 4.93274
130 4YMJ 4EJ 0.0008436 0.50371 4.93421
131 5TO8 7FM 0.0008586 0.41143 4.96454
132 2QX0 PH2 0.009261 0.44549 5.03145
133 3LQV ADE 0.003043 0.47896 5.21739
134 5CKW ANP 0.000009702 0.58916 5.2459
135 3UIM ANP 0.00001971 0.54655 5.2459
136 4H3P ANP 0.00004249 0.53083 5.2459
137 2PUL ACP 0.00008872 0.52128 5.2459
138 4BHN BH9 0.0005893 0.4683 5.2459
139 4XYM A12 0.0009436 0.46311 5.2459
140 4QTB 38Z 0.0003889 0.45024 5.2459
141 3Q60 ATP 0.005158 0.43633 5.2459
142 1OBD ATP 0.0103 0.42932 5.2459
143 1YQC GLV 0.0008066 0.51261 5.29412
144 5A6N U7E 0.000002447 0.58254 5.30035
145 4M69 ANP 0.0002659 0.48395 5.30035
146 4KS7 X4Z 0.0009355 0.45159 5.47945
147 3C0G 3AM 0.00001149 0.57783 5.57377
148 4F9C 0SX 0.00003293 0.54198 5.57377
149 4JDI ANP 0.0005356 0.47018 5.57377
150 4U98 ACP 0.001029 0.47006 5.57377
151 3ALN ANP 0.0007867 0.46261 5.57377
152 4OUC 5ID 0.002404 0.45662 5.57377
153 4H3Q ANP 0.0008306 0.45384 5.57377
154 2Q7D ANP 0.0008526 0.44294 5.57377
155 2F57 23D 0.005331 0.43959 5.57377
156 2VPQ ANP 0.005043 0.41966 5.57377
157 3KRL KRL 0.01117 0.40738 5.57377
158 1PHK ATP 0.000003993 0.57271 5.7047
159 5N1X 8HH 0.001189 0.47633 5.78512
160 4ZGP ADP 0.01106 0.42033 5.80205
161 2QCS ANP 0.0000892 0.48345 5.84192
162 4X7Q 3YR 0.00001631 0.55042 5.90164
163 4AZW ATP 0.0000126 0.54392 5.90164
164 4AZT LY2 0.00008589 0.54045 5.90164
165 1Y57 MPZ 0.00005908 0.50389 5.90164
166 4BFM ANP 0.0001103 0.50125 5.90164
167 2H8H H8H 0.0008692 0.46906 5.90164
168 5UOX 8GY 0.0005076 0.46711 5.90406
169 1VJY 460 0.0002515 0.44809 5.94059
170 1OIJ AKG 0.03069 0.41527 5.98007
171 4OTH DRN 0.000009479 0.5439 6.15836
172 4EWH T77 0.0003982 0.45315 6.18182
173 1TZD ADP 0.01767 0.4165 6.18182
174 3KN5 ANP 0.000005688 0.59318 6.22951
175 3W0O ADP 0.0000047 0.52235 6.22951
176 3W0O HY0 0.0000047 0.52235 6.22951
177 1CM8 ANP 0.0002295 0.50142 6.22951
178 4R78 AMP 0.001022 0.49074 6.22951
179 4IJP 1EH 0.0009147 0.45965 6.22951
180 4AUA 4AU 0.003042 0.44739 6.22951
181 4GLW 0XT 0.008999 0.44086 6.22951
182 5MJA 7O3 0.005809 0.43775 6.22951
183 4CRL C1I 0.00102 0.42229 6.22951
184 1JPA ANP 0.005549 0.41224 6.22951
185 2RIF AMP 0.01385 0.41911 6.38298
186 5JZJ AN2 0.00009607 0.51961 6.39731
187 5AIG VPR 0.03468 0.4097 6.4
188 1W2D ADP 0.007599 0.44023 6.41509
189 1W2D 4IP 0.003389 0.41267 6.41509
190 4ZS4 ATP 0.0008719 0.46469 6.51466
191 3AQV TAK 0.02185 0.40286 6.52174
192 4IX4 ADP 0.00001045 0.54759 6.55738
193 4UX9 ANP 0.0002995 0.48161 6.55738
194 3E7S AT2 0.02554 0.42493 6.55738
195 3M2W L8I 0.00008331 0.53459 6.68896
196 3PLS ANP 0.0001852 0.5059 6.71141
197 5H2U 1N1 0.01834 0.40343 6.74157
198 5DA3 58V 0.005186 0.44879 6.79245
199 5AX9 4KT 0.0002177 0.49739 6.88525
200 4U44 3D9 0.0003011 0.49076 6.88525
201 3VM7 GLC 0.04605 0.41249 6.88525
202 3K60 ADP 0.04024 0.41008 7.17489
203 4OCV ANP 0.000004934 0.56847 7.21311
204 2YAB AMP 0.000005975 0.56463 7.21311
205 5HVJ ANP 0.001767 0.48258 7.21311
206 5LXT ACP 0.002474 0.43316 7.21311
207 5K2M ADP 0.00632 0.41245 7.32601
208 4C2W ANP 0.0009645 0.48642 7.52688
209 3MVH WFE 0.000005191 0.52065 7.54098
210 3I0O ADP 0.0005701 0.49817 7.54098
211 2IF8 ADP 0.001691 0.48489 7.54098
212 4LOO SB4 0.009121 0.42087 7.54098
213 3E8N VRA 0.0004817 0.40349 7.54098
214 3E8N ATP 0.0004817 0.40349 7.54098
215 5DH3 5BS 0.01588 0.40338 7.54098
216 3SLS ANP 0.0006026 0.4638 7.56579
217 4Y0X ADP 0.00002056 0.5583 7.86885
218 4O1P ANP 0.0006176 0.47605 7.86885
219 2PZI AXX 0.005249 0.4441 7.86885
220 4CYI ATP 0.008067 0.41678 7.86885
221 1V0O INR 0.0008059 0.46627 7.98611
222 3PDT ADP 0.001577 0.46562 8
223 2GQR ADP 0.01251 0.41774 8.01688
224 2GQS ADP 0.0132 0.41661 8.01688
225 2GQS C2R 0.01995 0.41126 8.01688
226 4O4F ATP 0.0001576 0.4771 8.06452
227 4O4F IHP 0.0001773 0.47112 8.06452
228 2HK5 1BM 0.002165 0.4427 8.14815
229 3F7Z 34O 0.00001668 0.54997 8.19672
230 3ZRM ZRM 0.0000244 0.54219 8.19672
231 2JLD AG1 0.000003346 0.51528 8.19672
232 3HZT J60 0.0004185 0.50508 8.19672
233 4NM5 ADP 0.0001443 0.48699 8.19672
234 3LXN MI1 0.0004435 0.47389 8.19672
235 4FL3 ANP 0.0007797 0.45883 8.19672
236 5N87 N66 0.000197 0.4431 8.19672
237 5LXC 7AA 0.00002444 0.40172 8.19672
238 3SXS PP2 0.0144 0.40532 8.20895
239 5XQL C2E 0.0217 0.4426 8.24742
240 4WW7 AMP 0.000001221 0.58344 8.42912
241 5HWV MBN 0.01835 0.42877 8.46154
242 3VHE 42Q 0.00106 0.42992 8.52459
243 5HCY 60D 0.0004043 0.4087 8.52459
244 1ZY5 ANP 0.00008529 0.5221 8.58086
245 4E1Z 0MX 0.0007763 0.45512 8.59107
246 4GJ3 0XP 0.0008935 0.42994 8.60927
247 1AV5 AP2 0.03078 0.4052 8.73016
248 2RIO ADP 0.000435 0.48805 8.85246
249 4AU8 Z3R 0.0117 0.43055 9.12162
250 4JR7 GNP 0.000002961 0.58534 9.18033
251 3OFM 4B0 0.000009549 0.58187 9.18033
252 4YLL 4E3 0.0001033 0.49331 9.18033
253 2HY0 306 0.001333 0.47405 9.18033
254 3PE2 E1B 0.00002564 0.43996 9.18033
255 3TKI S25 0.00001019 0.42817 9.18033
256 3O0G 3O0 0.0002954 0.49614 9.24658
257 1UNH IXM 0.003846 0.4509 9.24658
258 2W9S TOP 0.04419 0.41046 9.31677
259 1CBK ROI 0.04015 0.412 9.375
260 3GNI ATP 0.0002114 0.48846 9.38416
261 2Z7R STU 0.00003947 0.51639 9.5082
262 2R5T ANP 0.0001302 0.49336 9.5082
263 4OCJ NDG 0.000006066 0.49075 9.5082
264 5LI1 ANP 0.0002156 0.48363 9.5082
265 5LI9 ACP 0.0003397 0.4836 9.5082
266 5VZ0 ADP 0.002722 0.44971 9.5082
267 4DC2 ADE 0.008058 0.44928 9.5082
268 5IH1 GDP 0.000002967 0.45351 9.60265
269 5IH1 6BQ 0.000004777 0.44748 9.60265
270 3GC0 AMP 0.001954 0.4657 9.83607
271 3FHR P4O 0.01054 0.41462 9.83607
272 3N1S 5GP 0.01299 0.42423 10.084
273 2BE5 TGT 0.04771 0.404 10.101
274 5W2I I3P 0.002696 0.42832 10.1167
275 5W2I ADP 0.002696 0.42832 10.1167
276 5EFQ ADP 0.00008867 0.51578 10.1639
277 4NST ADP 0.0001094 0.51147 10.1639
278 3UDZ ADP 0.00008554 0.51126 10.1639
279 4L9I 8PR 0.0003168 0.49468 10.1639
280 4NST AF3 0.0004658 0.40445 10.1639
281 5L8L ADP 0.002037 0.46971 10.1754
282 5LXM ADP 0.0004868 0.4857 10.2473
283 4XMF HSM 0.000456 0.51672 10.3261
284 3X01 AMP 0.0002583 0.53204 10.4918
285 3VY6 BGC BGC 0.02366 0.40685 10.6383
286 5CEO 50D 0.002834 0.44485 10.6667
287 5TDF ADP 0.0002653 0.48399 10.8197
288 3FHI ANP 0.000161 0.47286 11.039
289 5EQY 5RA 0.0001698 0.41278 11.1475
290 1I7L ATP 0.006585 0.41168 11.1475
291 5HQ0 LZ9 0.0001279 0.49835 11.3553
292 4WNP 3RJ 0.0001525 0.52139 11.4983
293 2BPM 529 0.00001213 0.4428 11.8033
294 3LXK MI1 0.001068 0.43575 11.8033
295 4CFU 2WC 0.000194 0.51037 11.8812
296 4BCQ TJF 0.001466 0.47706 11.9601
297 4BCM T7Z 0.003389 0.46857 11.9601
298 4BCN T9N 0.000368 0.50216 12
299 5LMK 6ZK 0.00972 0.42672 12.1212
300 5I35 ANP 0.00000226 0.59796 12.1311
301 2PVF ACP 0.00004792 0.53415 12.1311
302 3HMO STU 0.0002028 0.504 12.1311
303 3RI1 3RH 0.0004567 0.45414 12.1311
304 1ZTH ADP 0.00001859 0.57463 12.4031
305 1ZP9 ATP 0.00004149 0.54331 12.4031
306 3RE4 TO1 0.0002181 0.51963 12.4031
307 4GYI ADP 0.00004283 0.54911 12.459
308 3GQI ACP 0.00001944 0.54683 12.459
309 5UR1 YY9 0.003571 0.40667 12.459
310 2WEL K88 0.02461 0.42289 12.6667
311 4BTK DTQ 0.000001605 0.59787 12.7869
312 4NFN 2KC 0.00000777 0.57216 12.7869
313 3H0L ADP 0.04758 0.40231 12.7869
314 4D2S DYK 0.03177 0.4045 13.0282
315 4E93 GUI 0.0001447 0.45723 13.1148
316 5M06 ADP 0.0008334 0.47925 13.4058
317 5H06 MAL 0.02145 0.42575 13.4426
318 5G1X ADP 0.001832 0.458 14.2857
319 3VPB ADP 0.004204 0.41711 14.2857
320 2X2M X2M 0.0006235 0.46314 14.4262
321 2A19 ANP 0.00001294 0.58272 14.8571
322 5IGI GMP 0.000004403 0.49928 15.2824
323 5IGI ZIT 0.00000561 0.49194 15.2824
324 5USZ SKE 0.0001748 0.46768 15.5709
325 4XLI 1N1 0.001284 0.46543 15.6716
326 4Y8D 49J 0.0003202 0.4895 15.7377
327 5DBX ANP 0.0003533 0.50305 16.0656
328 2B9J ADP 0.000237 0.50074 16.3934
329 2B9F ADP 0.000257 0.494 16.3934
330 2B9H ADP 0.0002294 0.49148 16.3934
331 2B9I ADP 0.0003362 0.4885 16.3934
332 3DAK ANP 0.00008849 0.52714 16.8966
333 4CSV STI 0.01412 0.40007 19.2727
334 4Q5H ANP 0.0000008362 0.61121 22.3684
335 4A4X JUP 0.0006504 0.4478 23.6559
336 3PVW QRX 0.00002143 0.50903 24.3243
337 3CY2 MB9 0.000006981 0.54432 24.918
338 4N70 2HX 0.000004243 0.45486 24.918
339 5UKL SIX 0.0009166 0.43845 25.8065
340 2BKK ADP 0.000007313 0.5877 26.8939
341 3TM0 ANP 0.0000147 0.49499 26.9962
342 3TM0 B31 0.00001801 0.48792 26.9962
343 4WB6 ATP 0.0002068 0.46836 30
344 2GU8 796 0.00001346 0.42278 30
345 4WB7 ATP 0.002362 0.40393 30
346 3KMW ATP 0.002502 0.45148 37.9845
347 3TDV GDP 0.00000005741 0.66603 42.9508
348 4DFU QUE 0.000002252 0.64024 47.541
349 4DFB KAN 0.00002077 0.58813 47.541
350 4DFU KAN 0.00005987 0.55565 47.541
351 5C4L 4XR 0.00000000005719 0.70793 49.1803
352 5C4L SIS 0.0000000001941 0.68743 49.1803
Pocket No.: 2; Query (leader) PDB : 5IQD; Ligand: GNP; Similar sites found: 352
This union binding pocket(no: 2) in the query (biounit: 5iqd.bio2) has 36 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2VQD AP2 0.006534 0.41983 1.31148
2 4D52 GXL 0.04523 0.40255 1.63934
3 2WEI VGG 0.01231 0.42058 1.74216
4 1XJD STU 0.00001421 0.54574 1.96721
5 5MRH Q9Z 0.002351 0.47048 1.96721
6 5C1P ADP 0.004003 0.44889 1.96721
7 5C1P DAL DAL 0.009864 0.40041 1.96721
8 1K3A ACP 0.0006351 0.48898 2.00669
9 3ORQ ADP 0.009684 0.41209 2.12202
10 1TQP ATP 0.000003558 0.54998 2.12766
11 3BU5 ATP 0.00001889 0.54591 2.29508
12 5DMZ ADP 0.0003319 0.48746 2.29508
13 5AWM ANP 0.002083 0.46803 2.29508
14 5VCV 1N1 0.0003973 0.46264 2.29508
15 4KBA 1QM 0.0006188 0.44411 2.29508
16 4Y85 499 0.006626 0.42998 2.29508
17 2PNC CLU 0.03763 0.41222 2.29508
18 3EKK GS2 0.001123 0.41202 2.29508
19 5W4W 9WG 0.003432 0.40619 2.29508
20 4YZN 4K5 0.00002292 0.52033 2.43902
21 3DLS ADP 0.00003455 0.54575 2.62295
22 2WQN ADP 0.0006801 0.48749 2.62295
23 3TII ANP 0.004499 0.45085 2.62295
24 4LH7 1X8 0.01087 0.43245 2.62295
25 1PK8 ATP 0.006568 0.40784 2.62295
26 3PP0 03Q 0.006899 0.40427 2.62295
27 4L3L 5FI 0.00001179 0.50511 2.63158
28 3GGF GVD 0.0003757 0.49497 2.65781
29 4M6T SAM 0.01086 0.44484 2.73224
30 2AQX ATP 0.002257 0.43714 2.76817
31 5X8I SQZ 0.000003676 0.5793 2.95082
32 5MY8 RXZ 0.00002536 0.50898 2.95082
33 5MW8 ATP 0.00006243 0.50142 2.95082
34 2YW2 ATP 0.0004928 0.47054 2.95082
35 3AKK ADP 0.0006596 0.46903 2.95082
36 3ORK AGS 0.0002364 0.46837 2.95082
37 3ZGJ RMN 0.004432 0.46113 2.95082
38 5NCY 8TK 0.0009336 0.43084 2.95082
39 3GC8 B45 0.003641 0.42793 2.95082
40 2JDR L20 0.00001308 0.41605 2.95082
41 2JDR GLY ARG PRO ARG THR THR SER PHE ALA GLU 0.00001308 0.41605 2.95082
42 4UAA 3GK 0.037 0.40356 3.04183
43 4UA7 3GK 0.03726 0.4034 3.04183
44 4DE2 DN3 0.0441 0.40312 3.04183
45 4DDY DN6 0.04004 0.40177 3.04183
46 4DDS 0J7 0.04315 0.40006 3.04183
47 2XOC ADP 0.009209 0.41873 3.06513
48 3ZJX BOG 0.009607 0.44386 3.11419
49 3SRV S19 0.00001068 0.56396 3.2491
50 2OFV 242 0.002376 0.40267 3.2491
51 3TXO 07U 0.0000271 0.55092 3.27869
52 4XH0 ADP 0.0007308 0.50381 3.27869
53 2QK4 ATP 0.004298 0.45669 3.27869
54 3WVR AMP 0.002824 0.45202 3.27869
55 4PU5 ANP 0.001251 0.44487 3.27869
56 5GZ9 ANP 0.001364 0.44323 3.27869
57 3PN1 IVH 0.01108 0.43963 3.27869
58 3V4S ATP 0.002429 0.43572 3.27869
59 3ETH ATP 0.003531 0.42853 3.27869
60 4YZC STU 0.0004928 0.42475 3.27869
61 5DXT 5H5 0.007449 0.42052 3.27869
62 4F4P 0SB 0.00003735 0.40021 3.2967
63 2XVD AS6 0.003098 0.41307 3.31126
64 3K5I ADP 0.001339 0.45094 3.47395
65 1U59 STU 0.000001987 0.59184 3.48432
66 2YAK OSV 0.0000007714 0.55145 3.50877
67 5DZT AMP 0.0001416 0.54384 3.60656
68 3VOT ADP 0.0002635 0.51408 3.60656
69 1RE8 BD2 0.000003682 0.4652 3.60656
70 4CC6 L5Y 0.005977 0.44915 3.60656
71 4G17 0VN 0.005477 0.43789 3.60656
72 4EUU BX7 0.001459 0.43209 3.60656
73 5UIU 8CG 0.001019 0.42935 3.60656
74 3H9R TAK 0.02964 0.41235 3.60656
75 3IDB ANP 0.00008212 0.49625 3.72671
76 2Y6O 1N1 0.002453 0.43554 3.78007
77 2V7O DRN 0.000001304 0.64153 3.93443
78 1Q8Y ADE 0.00004851 0.55903 3.93443
79 2PVN P63 0.00001013 0.51196 3.93443
80 1Q8Y ADP 0.0003642 0.47646 3.93443
81 4WNK 453 0.00006589 0.47589 3.93443
82 4Y93 746 0.001123 0.44001 3.93443
83 1I9Z 2IP 0.02232 0.41023 3.93443
84 4XV1 904 0.001708 0.41271 4.10959
85 3VPC ADP 0.005373 0.42043 4.25532
86 2PYW ADP 0.00002421 0.52959 4.2623
87 5LVP ATP 0.0001241 0.52452 4.2623
88 2WU6 DKI 0.00001944 0.52343 4.2623
89 4FG8 ATP 0.00005543 0.51335 4.2623
90 1U5R ATP 0.0001671 0.50146 4.2623
91 4OAV ACP 0.0002722 0.49653 4.2623
92 5U6C 7YS 0.0001368 0.49104 4.2623
93 4IDT T28 0.0003944 0.4888 4.2623
94 1M0W ANP 0.001691 0.46293 4.2623
95 4QMN DB8 0.0002169 0.44025 4.2623
96 5T8O 76Z 0.002491 0.43877 4.2623
97 5HX8 66P 0.0002123 0.46655 4.30464
98 4FE2 ADP 0.01699 0.41729 4.31373
99 1BYG STU 0.0004738 0.49003 4.31655
100 4CQE CQE 0.001139 0.45029 4.31655
101 2VN9 GVD 0.0002282 0.5237 4.31894
102 4OH4 ANP 0.00002511 0.54011 4.59016
103 3V8S 0HD 0.00004718 0.53303 4.59016
104 4K33 ACP 0.00003508 0.52767 4.59016
105 2ZV2 609 0.000212 0.51893 4.59016
106 4IZY 1J2 0.00009331 0.50315 4.59016
107 5LPZ ADP 0.000303 0.48932 4.59016
108 3PTG 932 0.00115 0.48681 4.59016
109 3IGO ANP 0.0001972 0.48401 4.59016
110 2VZ6 FEF 0.001321 0.47304 4.59016
111 3DNT ATP 0.0004603 0.45992 4.59016
112 3TPV ADE 0.002134 0.44555 4.59016
113 3TTI KBI 0.0006772 0.44253 4.59016
114 4ANW O92 0.0005054 0.43529 4.59016
115 4PZ6 GMP 0.01801 0.4296 4.59016
116 5JGA 6KC 0.003296 0.40442 4.59016
117 5KO1 6UY 0.0003213 0.49307 4.59364
118 4USF 6UI 0.007195 0.43609 4.60526
119 1IA9 ANP 0.003371 0.4364 4.64286
120 4I94 ANP 0.0006847 0.47731 4.66667
121 5LPB ADP 0.008702 0.43611 4.72973
122 4LRJ ANP 0.00005727 0.52899 4.73373
123 5VC5 96M 0.0004992 0.44789 4.84429
124 5C03 AGS 0.00003738 0.532 4.91803
125 4UWH JXM 0.0001141 0.52033 4.91803
126 4WOV 3SM 0.0008637 0.48229 4.91803
127 4NW6 2NS 0.0001805 0.45222 4.91803
128 5TA6 79D 0.005953 0.40429 4.91803
129 1Y7P RIP 0.009827 0.43138 4.93274
130 4YMJ 4EJ 0.000801 0.50371 4.93421
131 5TO8 7FM 0.0007281 0.41143 4.96454
132 2QX0 PH2 0.008878 0.44549 5.03145
133 3LQV ADE 0.002917 0.47896 5.21739
134 5CKW ANP 0.00000905 0.58916 5.2459
135 3UIM ANP 0.00001831 0.54655 5.2459
136 4H3P ANP 0.00003958 0.53083 5.2459
137 2PUL ACP 0.00008296 0.52128 5.2459
138 4BHN BH9 0.0005524 0.4683 5.2459
139 4XYM A12 0.0008482 0.464 5.2459
140 4QTB 38Z 0.0003608 0.45024 5.2459
141 3Q60 ATP 0.004889 0.43633 5.2459
142 1OBD ATP 0.009808 0.42932 5.2459
143 1YQC GLV 0.0007716 0.51261 5.29412
144 5A6N U7E 0.000002253 0.58254 5.30035
145 4M69 ANP 0.0002485 0.48395 5.30035
146 4KS7 X4Z 0.0008762 0.45159 5.47945
147 3C0G 3AM 0.00001071 0.57783 5.57377
148 4F9C 0SX 0.0000307 0.54198 5.57377
149 4JDI ANP 0.0005018 0.47018 5.57377
150 4U98 ACP 0.0009696 0.47006 5.57377
151 3ALN ANP 0.0007382 0.46261 5.57377
152 4OUC 5ID 0.002276 0.45662 5.57377
153 4H3Q ANP 0.0007776 0.45384 5.57377
154 2Q7D ANP 0.0007954 0.44294 5.57377
155 2F57 23D 0.005059 0.43959 5.57377
156 2VPQ ANP 0.004752 0.41966 5.57377
157 3KRL KRL 0.01057 0.40738 5.57377
158 1ZX5 LFR 0.04869 0.41835 5.66667
159 1PHK ATP 0.000003684 0.57271 5.7047
160 5N1X 8HH 0.001142 0.47633 5.78512
161 4ZGP ADP 0.01051 0.42033 5.80205
162 2QCS ANP 0.00008249 0.48345 5.84192
163 4X7Q 3YR 0.00001514 0.55042 5.90164
164 4AZW ATP 0.00001067 0.54565 5.90164
165 4AZT LY2 0.00008065 0.54045 5.90164
166 1Y57 MPZ 0.00005478 0.50389 5.90164
167 4BFM ANP 0.0001028 0.50125 5.90164
168 2H8H H8H 0.0008178 0.46906 5.90164
169 5UOX 8GY 0.0004749 0.46711 5.90406
170 1VJY 460 0.000232 0.44809 5.94059
171 1OIJ AKG 0.02953 0.41527 5.98007
172 4OTH DRN 0.000008744 0.5439 6.15836
173 4EWH T77 0.0003699 0.45315 6.18182
174 1TZD ADP 0.01697 0.4165 6.18182
175 3KN5 ANP 0.000005288 0.59318 6.22951
176 3W0O HY0 0.000004277 0.52235 6.22951
177 3W0O ADP 0.000004277 0.52235 6.22951
178 1CM8 ANP 0.0002152 0.50142 6.22951
179 4R78 AMP 0.000968 0.49074 6.22951
180 4IJP 1EH 0.0008587 0.45965 6.22951
181 4AUA 4AU 0.002878 0.44739 6.22951
182 4GLW 0XT 0.008584 0.44086 6.22951
183 5MJA 7O3 0.005514 0.43775 6.22951
184 4CRL C1I 0.000934 0.42249 6.22951
185 1JPA ANP 0.005334 0.41224 6.22951
186 2RIF AMP 0.01319 0.41911 6.38298
187 5JZJ AN2 0.00008986 0.51961 6.39731
188 5AIG VPR 0.03323 0.4097 6.4
189 1W2D ADP 0.007237 0.44023 6.41509
190 1W2D 4IP 0.004054 0.40842 6.41509
191 4ZS4 ATP 0.0008194 0.46469 6.51466
192 3AQV TAK 0.0208 0.40286 6.52174
193 4IX4 ADP 0.000009658 0.54759 6.55738
194 4UX9 ANP 0.0002801 0.48161 6.55738
195 3E7S AT2 0.02456 0.42493 6.55738
196 3M2W L8I 0.00007811 0.53459 6.68896
197 3PLS ANP 0.0001736 0.5059 6.71141
198 5H2U 1N1 0.01743 0.40343 6.74157
199 5DA3 58V 0.004933 0.44879 6.79245
200 5AX9 4KT 0.0002039 0.49739 6.88525
201 4U44 3D9 0.0002823 0.49076 6.88525
202 4OCV ANP 0.000004555 0.56847 7.21311
203 2YAB AMP 0.00000552 0.56463 7.21311
204 5HVJ ANP 0.001683 0.48258 7.21311
205 5LXT ACP 0.002326 0.43316 7.21311
206 5K2M ADP 0.005955 0.41245 7.32601
207 4C2W ANP 0.0009125 0.48642 7.52688
208 3MVH WFE 0.000004727 0.52065 7.54098
209 3I0O ADP 0.0005385 0.49817 7.54098
210 2IF8 ADP 0.001607 0.48489 7.54098
211 4LOO SB4 0.008652 0.42087 7.54098
212 5DH3 5BS 0.01506 0.40338 7.54098
213 3E8N VRA 0.0004329 0.40337 7.54098
214 3E8N ATP 0.0004329 0.40337 7.54098
215 3SLS ANP 0.0005641 0.4638 7.56579
216 4Y0X ADP 0.00001916 0.5583 7.86885
217 4O1P ANP 0.0005805 0.47605 7.86885
218 2PZI AXX 0.004986 0.4441 7.86885
219 4CYI ATP 0.007633 0.41678 7.86885
220 1V0O INR 0.0007572 0.46627 7.98611
221 3PDT ADP 0.001491 0.46562 8
222 2GQR ADP 0.01189 0.41774 8.01688
223 2GQS ADP 0.01255 0.41661 8.01688
224 2GQS C2R 0.01902 0.41126 8.01688
225 4O4F ATP 0.0001616 0.47529 8.06452
226 4O4F IHP 0.0001817 0.46934 8.06452
227 2HK5 1BM 0.002038 0.4427 8.14815
228 3F7Z 34O 0.00001549 0.54997 8.19672
229 3ZRM ZRM 0.00002268 0.54219 8.19672
230 2JLD AG1 0.000002754 0.51681 8.19672
231 3HZT J60 0.0003949 0.50508 8.19672
232 4NM5 ADP 0.0001342 0.48699 8.19672
233 3LXN MI1 0.0004153 0.47389 8.19672
234 4FL3 ANP 0.0007306 0.45883 8.19672
235 5N87 N66 0.0001809 0.4431 8.19672
236 4WOE ADP 0.04615 0.40705 8.19672
237 5LXC 7AA 0.00002275 0.40653 8.19672
238 3SXS PP2 0.01366 0.40532 8.20895
239 5XQL C2E 0.02096 0.4426 8.24742
240 4WW7 AMP 0.000001118 0.58344 8.42912
241 5HWV MBN 0.01756 0.42877 8.46154
242 3VHE 42Q 0.0009858 0.42992 8.52459
243 5HCY 60D 0.0002675 0.41087 8.52459
244 1ZY5 ANP 0.00007975 0.5221 8.58086
245 4E1Z 0MX 0.0007266 0.45512 8.59107
246 4GJ3 0XP 0.0008296 0.42994 8.60927
247 1AV5 AP2 0.02943 0.4052 8.73016
248 2RIO ADP 0.0004089 0.48805 8.85246
249 4AU8 Z3R 0.01116 0.43055 9.12162
250 4JR7 GNP 0.000002733 0.58534 9.18033
251 3OFM 4B0 0.000008892 0.58187 9.18033
252 4YLL 4E3 0.00009599 0.49331 9.18033
253 2HY0 306 0.001261 0.47405 9.18033
254 3PE2 E1B 0.00002088 0.43996 9.18033
255 3TKI S25 0.00000819 0.42778 9.18033
256 3O0G 3O0 0.0002774 0.49614 9.24658
257 1UNH IXM 0.00365 0.4509 9.24658
258 2W9S TOP 0.04247 0.41046 9.31677
259 1CBK ROI 0.03858 0.412 9.375
260 3GNI ATP 0.0001974 0.48846 9.38416
261 2Z7R STU 0.00003659 0.51639 9.5082
262 2R5T ANP 0.0001212 0.49336 9.5082
263 4OCJ NDG 0.00000524 0.49075 9.5082
264 5LI1 ANP 0.0002011 0.48363 9.5082
265 5LI9 ACP 0.0003182 0.4836 9.5082
266 5VZ0 ADP 0.002575 0.44971 9.5082
267 4DC2 ADE 0.007712 0.44928 9.5082
268 5IH1 GDP 0.000003395 0.44859 9.60265
269 5IH1 6BQ 0.000005294 0.44236 9.60265
270 3GC0 AMP 0.00185 0.4657 9.83607
271 3FHR P4O 0.009994 0.41462 9.83607
272 3N1S 5GP 0.01238 0.42423 10.084
273 2BE5 TGT 0.04597 0.404 10.101
274 5W2I ADP 0.002762 0.42671 10.1167
275 5W2I I3P 0.002762 0.42671 10.1167
276 5EFQ ADP 0.00008279 0.51578 10.1639
277 4NST ADP 0.0001023 0.51147 10.1639
278 3UDZ ADP 0.00007975 0.51126 10.1639
279 4L9I 8PR 0.0002975 0.49468 10.1639
280 4NST AF3 0.0004466 0.40445 10.1639
281 5L8L ADP 0.001931 0.46971 10.1754
282 5LXM ADP 0.0004577 0.4857 10.2473
283 4XMF HSM 0.0004356 0.51672 10.3261
284 3X01 AMP 0.0002444 0.53204 10.4918
285 3VY6 BGC BGC 0.02283 0.40685 10.6383
286 5CEO 50D 0.002678 0.44485 10.6667
287 5TDF ADP 0.000248 0.48399 10.8197
288 3FHI ANP 0.0001492 0.47286 11.039
289 5EQY 5RA 0.0001575 0.41173 11.1475
290 1I7L ATP 0.006205 0.41168 11.1475
291 5HQ0 LZ9 0.0001192 0.49835 11.3553
292 4WNP 3RJ 0.0001432 0.52139 11.4983
293 2BPM 529 0.00001019 0.4421 11.8033
294 3LXK MI1 0.000996 0.43575 11.8033
295 4CFU 2WC 0.0001822 0.51037 11.8812
296 4BCQ TJF 0.001388 0.47706 11.9601
297 4BCM T7Z 0.003227 0.46857 11.9601
298 4BCN T9N 0.0003467 0.50216 12
299 5LMK 6ZK 0.009243 0.42672 12.1212
300 5I35 ANP 0.000002088 0.59796 12.1311
301 2PVF ACP 0.00004472 0.53415 12.1311
302 3HMO STU 0.0001902 0.504 12.1311
303 3RI1 3RH 0.0004251 0.45414 12.1311
304 1ZTH ADP 0.00001738 0.57463 12.4031
305 1ZP9 ATP 0.00003875 0.54331 12.4031
306 3RE4 TO1 0.0002054 0.51963 12.4031
307 4GYI ADP 0.00004007 0.54911 12.459
308 3GQI ACP 0.00001806 0.54683 12.459
309 5UR1 YY9 0.003335 0.40667 12.459
310 2WEL K88 0.02361 0.42289 12.6667
311 4BTK DTQ 0.000001479 0.59787 12.7869
312 4NFN 2KC 0.000007207 0.57216 12.7869
313 3H0L ADP 0.04565 0.40231 12.7869
314 4D2S DYK 0.03037 0.4045 13.0282
315 4E93 GUI 0.0001419 0.45618 13.1148
316 5M06 ADP 0.0007861 0.47925 13.4058
317 5H06 MAL 0.02062 0.42575 13.4426
318 5G1X ADP 0.00173 0.458 14.2857
319 3VPB ADP 0.003951 0.41711 14.2857
320 2X2M X2M 0.0005838 0.46314 14.4262
321 2A19 ANP 0.00001208 0.58272 14.8571
322 5IGI GMP 0.000004562 0.49713 15.2824
323 5IGI ZIT 0.000005058 0.48981 15.2824
324 5USZ SKE 0.0001373 0.47057 15.5709
325 4XLI 1N1 0.001211 0.46543 15.6716
326 4Y8D 49J 0.0003003 0.4895 15.7377
327 5DBX ANP 0.0003328 0.50305 16.0656
328 2B9J ADP 0.0002224 0.50074 16.3934
329 2B9F ADP 0.0002409 0.494 16.3934
330 2B9H ADP 0.0002146 0.49148 16.3934
331 2B9I ADP 0.0003153 0.4885 16.3934
332 3DAK ANP 0.00008286 0.52714 16.8966
333 4CSV STI 0.01336 0.40007 19.2727
334 4Q5H ANP 0.0000007687 0.61121 22.3684
335 4A4X JUP 0.0006061 0.4478 23.6559
336 3PVW QRX 0.00001971 0.50903 24.3243
337 3CY2 MB9 0.000006423 0.54432 24.918
338 4N70 2HX 0.000003618 0.45371 24.918
339 5UKL SIX 0.0008542 0.43845 25.8065
340 2BKK ADP 0.000006804 0.5877 26.8939
341 3TM0 ANP 0.00001577 0.49231 26.9962
342 3TM0 B31 0.00001795 0.48647 26.9962
343 4WB6 ATP 0.0001918 0.46836 30
344 2GU8 796 0.00001091 0.42278 30
345 4WB7 ATP 0.002192 0.40393 30
346 3KMW ATP 0.002366 0.45148 37.9845
347 3TDV GDP 0.0000000523 0.66603 42.9508
348 4DFU QUE 0.000002099 0.64024 47.541
349 4DFB KAN 0.00001838 0.58949 47.541
350 4DFU KAN 0.00005625 0.55565 47.541
351 5C4L 4XR 0.00000000004962 0.70793 49.1803
352 5C4L SIS 0.0000000002585 0.68034 49.1803
Pocket No.: 3; Query (leader) PDB : 5IQD; Ligand: GNP; Similar sites found: 10
This union binding pocket(no: 3) in the query (biounit: 5iqd.bio1) has 36 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2X1E X1E 0.02841 0.40871 1.96721
2 1YXM ADE 0.023 0.42282 2.9703
3 4DE3 DN8 0.02388 0.4098 3.04183
4 4DE1 0J6 0.03446 0.40171 3.04183
5 1OI6 TMP 0.0284 0.41933 4.87805
6 5FI4 5XV 0.007407 0.40839 5.90164
7 4ZYB 4SQ 0.02401 0.42138 5.97015
8 2NUO BGC 0.02417 0.41974 24.5902
9 2NU5 NAG 0.02481 0.40984 24.5902
10 2HYR BGC GLC 0.02481 0.40799 24.5902
Pocket No.: 4; Query (leader) PDB : 5IQD; Ligand: RIO; Similar sites found: 12
This union binding pocket(no: 4) in the query (biounit: 5iqd.bio1) has 37 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2X1E X1E 0.0295 0.40871 1.96721
2 1YXM ADE 0.0239 0.42282 2.9703
3 4DE3 DN8 0.025 0.4098 3.04183
4 4DE1 0J6 0.03602 0.40171 3.04183
5 1OI6 TMP 0.02953 0.41933 4.87805
6 1ZX5 LFR 0.04688 0.42097 5.66667
7 5FI4 5XV 0.007855 0.40839 5.90164
8 4ZYB 4SQ 0.02506 0.42138 5.97015
9 5DNU KKN 0.04789 0.40743 10.5455
10 2NUO BGC 0.02505 0.41974 24.5902
11 2NU5 NAG 0.02571 0.40984 24.5902
12 2HYR BGC GLC 0.02571 0.40799 24.5902
Pocket No.: 5; Query (leader) PDB : 5IQD; Ligand: RIO; Similar sites found: 9
This union binding pocket(no: 5) in the query (biounit: 5iqd.bio3) has 35 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2F7A BEZ 0.02622 0.4201 2.58621
2 5HV7 RBL 0.007195 0.4268 2.95082
3 5D9G GLU ASN LEU TYR PHE GLN 0.04808 0.40011 3.25203
4 3LJU IP9 0.04955 0.4058 3.93443
5 5DYO FLU 0.03082 0.41575 5.04587
6 4I6H 1C8 0.01655 0.4065 5.57377
7 1CKM GTP 0.04809 0.4001 5.57377
8 1FUT 2GP 0.01682 0.43085 6.60377
9 2HYQ MAN MAN 0.02681 0.40911 24.5902
Pocket No.: 6; Query (leader) PDB : 5IQD; Ligand: GNP; Similar sites found: 8
This union binding pocket(no: 6) in the query (biounit: 5iqd.bio3) has 34 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 5HV7 RBL 0.006914 0.4268 2.95082
2 5D9G GLU ASN LEU TYR PHE GLN 0.04601 0.40011 3.25203
3 3LJU IP9 0.0477 0.4058 3.93443
4 5DYO FLU 0.02955 0.41575 5.04587
5 4I6H 1C8 0.01568 0.4065 5.57377
6 1CKM GTP 0.04602 0.4001 5.57377
7 1FUT 2GP 0.01607 0.43085 6.60377
8 2HYQ MAN MAN 0.02582 0.40911 24.5902
Pocket No.: 7; Query (leader) PDB : 5IQD; Ligand: GNP; Similar sites found: 3
This union binding pocket(no: 7) in the query (biounit: 5iqd.bio4) has 36 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 3WXL ADP 0.03889 0.40671 1.96721
2 1I7E IBS 0.04183 0.40955 2.64151
3 3E5A VX6 0.009919 0.40031 10.8209
Pocket No.: 8; Query (leader) PDB : 5IQD; Ligand: RIO; Similar sites found: 4
This union binding pocket(no: 8) in the query (biounit: 5iqd.bio4) has 37 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 3WXL ADP 0.04038 0.40671 1.96721
2 1I7E IBS 0.04347 0.40955 2.64151
3 4FE2 ASP 0.0348 0.40379 4.31373
4 3QRC SCR 0.009639 0.44145 5.73248
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