Receptor
PDB id Resolution Class Description Source Keywords
1L5K 2 Å EC: 2.4.2.21 CRYSTAL STRUCTURE OF COBT COMPLEXED WITH N1-(5'-PHOSPHORIBOS BENZIMIDAZOLE AND NICOTINATE SALMONELLA ENTERICA COBT COBALAMIN SYNTHETIC ENZYME PHOSPHORIBOSYLTRANSFERASEDIMETHYLBENZIMIDAZOLE NICOTINATE MONONUCLEOTIDE TRANSFERA
Ref.: STRUCTURAL STUDIES OF THE L-THREONINE-O-3-PHOSPHATE DECARBOXYLASE (COBD) ENZYME FROM SALMONELLA ENTERIC APO, SUBSTRATE, AND PRODUCT-ALDIMINE COMPLEXES. BIOCHEMISTRY V. 41 9079 2002
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
1RB A:990;
Valid;
none;
submit data
330.23 C12 H15 N2 O7 P c1ccc...
NIO A:991;
Valid;
none;
submit data
123.109 C6 H5 N O2 c1cc(...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
4KQI 1.4 Å EC: 2.4.2.21 CRYSTAL STRUCTURE OF COBT E317A COMPLEXED WITH ITS REACTION SALMONELLA ENTERICA SUBSP. ENTERICA SETYPHIMURIUM TRANSFERASE
Ref.: DISSECTING COBAMIDE DIVERSITY THROUGH STRUCTURAL AN FUNCTIONAL ANALYSES OF THE BASE-ACTIVATING COBT ENZ SALMONELLA ENTERICA. BIOCHIM.BIOPHYS.ACTA V.1840 464 2014
Members (31)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1L4G - NCN C11 H14 N O9 P c1cc(c[n+]....
2 1D0S - DMD C9 H10 N2 Cc1cc2c(cc....
3 1L4K - NCN C11 H14 N O9 P c1cc(c[n+]....
4 4KQF - ADE C5 H5 N5 c1[nH]c2c(....
5 4KQJ - PCR C7 H8 O Cc1ccc(cc1....
6 1L4F - NCN C11 H14 N O9 P c1cc(c[n+]....
7 1JHV - PCR C7 H8 O Cc1ccc(cc1....
8 4KQG - DMD C9 H10 N2 Cc1cc2c(cc....
9 1L4N - NIO C6 H5 N O2 c1cc(cnc1)....
10 1JHM - 5MB C8 H8 N2 Cc1ccc2c(c....
11 1JHU - PCR C7 H8 O Cc1ccc(cc1....
12 1JH8 - ADE C5 H5 N5 c1[nH]c2c(....
13 1L4M - NCN C11 H14 N O9 P c1cc(c[n+]....
14 1L5L - NIO C6 H5 N O2 c1cc(cnc1)....
15 1L4L - XYD C8 H11 N Cc1ccc(c(c....
16 1JHQ - PMO C13 H17 N2 O8 P COc1ccc2c(....
17 1L5K - NIO C6 H5 N O2 c1cc(cnc1)....
18 1JHP - 5OB C8 H8 N2 O COc1ccc2c(....
19 1JHY - NIO C6 H5 N O2 c1cc(cnc1)....
20 1L5M - NIO C6 H5 N O2 c1cc(cnc1)....
21 1JHA - NIO C6 H5 N O2 c1cc(cnc1)....
22 1JHX - IPH C6 H6 O c1ccc(cc1)....
23 1JHO - RMB C13 H17 N2 O7 P Cc1ccc2c(c....
24 1JHR - P2P C10 H13 N4 O8 P c1c2c(ncn2....
25 1L4E - RBZ C14 H19 N2 O7 P Cc1cc2c(cc....
26 4KQK - PCR C7 H8 O Cc1ccc(cc1....
27 1D0V - RBZ C14 H19 N2 O7 P Cc1cc2c(cc....
28 1L5O - NCN C11 H14 N O9 P c1cc(c[n+]....
29 1L5F - BZI C7 H6 N2 c1ccc2c(c1....
30 1L4H - NCN C11 H14 N O9 P c1cc(c[n+]....
31 4KQI - NIO C6 H5 N O2 c1cc(cnc1)....
70% Homology Family (31)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1L4G - NCN C11 H14 N O9 P c1cc(c[n+]....
2 1D0S - DMD C9 H10 N2 Cc1cc2c(cc....
3 1L4K - NCN C11 H14 N O9 P c1cc(c[n+]....
4 4KQF - ADE C5 H5 N5 c1[nH]c2c(....
5 4KQJ - PCR C7 H8 O Cc1ccc(cc1....
6 1L4F - NCN C11 H14 N O9 P c1cc(c[n+]....
7 1JHV - PCR C7 H8 O Cc1ccc(cc1....
8 4KQG - DMD C9 H10 N2 Cc1cc2c(cc....
9 1L4N - NIO C6 H5 N O2 c1cc(cnc1)....
10 1JHM - 5MB C8 H8 N2 Cc1ccc2c(c....
11 1JHU - PCR C7 H8 O Cc1ccc(cc1....
12 1JH8 - ADE C5 H5 N5 c1[nH]c2c(....
13 1L4M - NCN C11 H14 N O9 P c1cc(c[n+]....
14 1L5L - NIO C6 H5 N O2 c1cc(cnc1)....
15 1L4L - XYD C8 H11 N Cc1ccc(c(c....
16 1JHQ - PMO C13 H17 N2 O8 P COc1ccc2c(....
17 1L5K - NIO C6 H5 N O2 c1cc(cnc1)....
18 1JHP - 5OB C8 H8 N2 O COc1ccc2c(....
19 1JHY - NIO C6 H5 N O2 c1cc(cnc1)....
20 1L5M - NIO C6 H5 N O2 c1cc(cnc1)....
21 1JHA - NIO C6 H5 N O2 c1cc(cnc1)....
22 1JHX - IPH C6 H6 O c1ccc(cc1)....
23 1JHO - RMB C13 H17 N2 O7 P Cc1ccc2c(c....
24 1JHR - P2P C10 H13 N4 O8 P c1c2c(ncn2....
25 1L4E - RBZ C14 H19 N2 O7 P Cc1cc2c(cc....
26 4KQK - PCR C7 H8 O Cc1ccc(cc1....
27 1D0V - RBZ C14 H19 N2 O7 P Cc1cc2c(cc....
28 1L5O - NCN C11 H14 N O9 P c1cc(c[n+]....
29 1L5F - BZI C7 H6 N2 c1ccc2c(c1....
30 1L4H - NCN C11 H14 N O9 P c1cc(c[n+]....
31 4KQI - NIO C6 H5 N O2 c1cc(cnc1)....
50% Homology Family (31)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 5 families.
1 1L4G - NCN C11 H14 N O9 P c1cc(c[n+]....
2 1D0S - DMD C9 H10 N2 Cc1cc2c(cc....
3 1L4K - NCN C11 H14 N O9 P c1cc(c[n+]....
4 4KQF - ADE C5 H5 N5 c1[nH]c2c(....
5 4KQJ - PCR C7 H8 O Cc1ccc(cc1....
6 1L4F - NCN C11 H14 N O9 P c1cc(c[n+]....
7 1JHV - PCR C7 H8 O Cc1ccc(cc1....
8 4KQG - DMD C9 H10 N2 Cc1cc2c(cc....
9 1L4N - NIO C6 H5 N O2 c1cc(cnc1)....
10 1JHM - 5MB C8 H8 N2 Cc1ccc2c(c....
11 1JHU - PCR C7 H8 O Cc1ccc(cc1....
12 1JH8 - ADE C5 H5 N5 c1[nH]c2c(....
13 1L4M - NCN C11 H14 N O9 P c1cc(c[n+]....
14 1L5L - NIO C6 H5 N O2 c1cc(cnc1)....
15 1L4L - XYD C8 H11 N Cc1ccc(c(c....
16 1JHQ - PMO C13 H17 N2 O8 P COc1ccc2c(....
17 1L5K - NIO C6 H5 N O2 c1cc(cnc1)....
18 1JHP - 5OB C8 H8 N2 O COc1ccc2c(....
19 1JHY - NIO C6 H5 N O2 c1cc(cnc1)....
20 1L5M - NIO C6 H5 N O2 c1cc(cnc1)....
21 1JHA - NIO C6 H5 N O2 c1cc(cnc1)....
22 1JHX - IPH C6 H6 O c1ccc(cc1)....
23 1JHO - RMB C13 H17 N2 O7 P Cc1ccc2c(c....
24 1JHR - P2P C10 H13 N4 O8 P c1c2c(ncn2....
25 1L4E - RBZ C14 H19 N2 O7 P Cc1cc2c(cc....
26 4KQK - PCR C7 H8 O Cc1ccc(cc1....
27 1D0V - RBZ C14 H19 N2 O7 P Cc1cc2c(cc....
28 1L5O - NCN C11 H14 N O9 P c1cc(c[n+]....
29 1L5F - BZI C7 H6 N2 c1ccc2c(c1....
30 1L4H - NCN C11 H14 N O9 P c1cc(c[n+]....
31 4KQI - NIO C6 H5 N O2 c1cc(cnc1)....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: 1RB; Similar ligands found: 49
No: Ligand ECFP6 Tc MDL keys Tc
1 1RB 1 1
2 RMB 0.635135 0.984127
3 PMO 0.618421 0.953846
4 RBZ 0.586667 0.953846
5 7RP 0.518987 0.953846
6 AMZ 0.513158 0.830986
7 C2R 0.513158 0.819444
8 P2P 0.5125 0.925373
9 7RA 0.5125 0.898551
10 AIR 0.506849 0.867647
11 NIA 0.5 0.766234
12 AMP 0.493671 0.911765
13 A 0.493671 0.911765
14 71V 0.481928 0.826667
15 FAI 0.47561 0.830986
16 JLN 0.47561 0.830986
17 AAM 0.47561 0.911765
18 IMO 0.47561 0.925373
19 5GP 0.465116 0.824324
20 PGS 0.465116 0.826667
21 G 0.465116 0.824324
22 IMP 0.458824 0.847222
23 93A 0.453488 0.753086
24 6C6 0.444444 0.849315
25 XMP 0.435294 0.835616
26 N6P 0.43299 0.939394
27 IRN 0.432432 0.951613
28 ITT 0.431818 0.911765
29 RVP 0.43038 0.814286
30 2SA 0.430108 0.849315
31 6K6 0.427083 0.898551
32 ATP 0.426966 0.885714
33 ADP 0.425287 0.885714
34 6IA 0.423913 0.805195
35 MGQ 0.42268 0.805195
36 5FA 0.422222 0.885714
37 AQP 0.422222 0.885714
38 G7M 0.420455 0.792208
39 BA3 0.413793 0.859155
40 A12 0.413793 0.849315
41 AP2 0.413793 0.849315
42 AMP MG 0.411765 0.833333
43 B4P 0.409091 0.859155
44 AP5 0.409091 0.859155
45 TAT 0.408602 0.849315
46 A2D 0.406977 0.859155
47 ABM 0.406977 0.859155
48 GUO 0.40625 0.808219
49 SRA 0.4 0.861111
Ligand no: 2; Ligand: NIO; Similar ligands found: 5
No: Ligand ECFP6 Tc MDL keys Tc
1 NIO 1 1
2 5F8 0.487805 0.789474
3 BEZ 0.433333 0.625
4 5HN 0.428571 0.695652
5 61O 0.418605 0.714286
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 4KQI; Ligand: RBZ; Similar sites found: 506
This union binding pocket(no: 1) in the query (biounit: 4kqi.bio1) has 45 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1B5E DCM 0.000264 0.4801 None
2 3T2W BTN 0.000447 0.46434 None
3 2E1A MSE 0.0008755 0.458 None
4 4N7C AEF 0.003893 0.45392 None
5 4KGM ATP 0.001266 0.44056 None
6 2OFD NGA 0.01045 0.42723 None
7 2OFE NAG 0.02789 0.40712 None
8 2YDW WSH 0.01367 0.40305 None
9 4HZO COA 0.0008373 0.46493 0.943396
10 3B1F NAD 0.002393 0.402 1.03448
11 1VDC FAD 0.001327 0.40414 1.2012
12 1VJO PLP 0.005989 0.40551 1.40449
13 3LRE ADP 0.04253 0.4071 1.40845
14 1NHZ 486 0.0009444 0.41548 1.42857
15 4OB6 S2T 0.00006641 0.47957 1.46628
16 4USS GSH 0.01875 0.40567 1.53846
17 3P7I P7I 0.00911 0.41948 1.55763
18 2VDJ HSE 0.004034 0.46035 1.66113
19 1GJW GLC 0.001393 0.47556 1.68539
20 1Q11 TYE 0.000821 0.4653 1.68539
21 3HZL 6PC 0.009401 0.449 1.68539
22 1GJW MAL 0.001547 0.44213 1.68539
23 1KTC NGA 0.003727 0.43652 1.68539
24 1H0C AOA 0.01452 0.42611 1.68539
25 2GWD GLU 0.005668 0.42354 1.68539
26 4C2G ALA ALA ALA ALA 0.005675 0.42351 1.68539
27 4M51 BEZ 0.02657 0.41894 1.68539
28 3VCA PRO 0.02006 0.40661 1.68539
29 1B4N GUA 0.04952 0.40207 1.68539
30 2Y0I AKG 0.009591 0.42354 1.70455
31 4OJ8 AKG 0.001151 0.42008 1.70648
32 4B7E OGA 0.004774 0.43728 1.7192
33 2WA4 069 0.003456 0.42309 1.7192
34 3P3N AKG 0.01767 0.41649 1.7192
35 1H2K OGA 0.01773 0.41642 1.7192
36 1H2M OGA 0.02 0.41395 1.7192
37 3K3G MMU 0.005292 0.4325 1.76471
38 1RZM E4P 0.0002285 0.5136 1.77515
39 1RZM PEP 0.01906 0.40535 1.77515
40 1P72 THM 0.001939 0.44896 1.79641
41 1NML CIT 0.0007772 0.46634 1.84049
42 2F59 INI 0.002561 0.41158 1.91083
43 1SG4 CO8 0.0005986 0.408 1.92308
44 2W8Q SIN 0.001293 0.47713 1.96629
45 4LIT AKG 0.007118 0.42942 1.96629
46 1MOQ GLP 0.001691 0.41807 1.96629
47 2FYF PLP 0.02518 0.41178 1.96629
48 1P1M MET 0.001906 0.40531 1.96629
49 2P41 G1G 0.002415 0.43929 1.96721
50 4G28 0W8 0.002653 0.43755 2.01342
51 3DER ALA LYS 0.002272 0.40617 2.02899
52 3A2Y TS5 0.0002361 0.45363 2.03046
53 1Z6K OAA 0.00501 0.41882 2.04778
54 4JP3 CIT 0.007886 0.40871 2.09205
55 3QDW A2G 0.001677 0.48824 2.0979
56 3QDY A2G GAL 0.00196 0.47613 2.0979
57 3QDY CBS 0.003671 0.45516 2.0979
58 3QDT A2G GAL 0.01649 0.42947 2.0979
59 3QDW NDG 0.02012 0.4192 2.0979
60 1B63 ANP 0.0003486 0.42991 2.1021
61 2ZSC BTN 0.006285 0.40858 2.12766
62 1KYQ NAD 0.00532 0.40016 2.18978
63 3GJB AKG 0.007057 0.41948 2.19436
64 3JQ3 ADP 0.0009302 0.45123 2.24719
65 3QV9 QV7 0.003762 0.44196 2.24719
66 3B9Z CO2 0.01112 0.42595 2.24719
67 2C5S AMP 0.005816 0.42306 2.24719
68 1A59 CIT 0.02071 0.41859 2.24719
69 3I8P 840 0.003037 0.4167 2.24719
70 1A59 COA 0.002285 0.41337 2.24719
71 1SNY NAP 0.0009631 0.40173 2.24719
72 1KDK DHT 0.00005478 0.45671 2.25989
73 1FP2 HMO 0.002481 0.42003 2.27273
74 1FP2 SAH 0.009165 0.40218 2.27273
75 1O9U ADZ 0.001439 0.49173 2.28571
76 1EB9 HBA 0.002805 0.42672 2.29008
77 2A2X NA9 0.0007847 0.43005 2.3166
78 2FEQ 34P 0.00484 0.40523 2.3166
79 3ITJ CIT 0.009702 0.43935 2.36686
80 1M1B SPV 0.00147 0.46044 2.37288
81 4IMG NGF 0.003617 0.40264 2.38908
82 4U9W COA 0.005129 0.4043 2.41546
83 1CKM GTP 0.001329 0.41789 2.42424
84 3NFZ 3NF 0.002923 0.426 2.44648
85 3DX5 DHB 0.001353 0.44453 2.44755
86 3EE4 MYR 0.0005011 0.42861 2.47678
87 4LH7 1X8 0.03995 0.40594 2.47678
88 1X92 M7P 0.0007372 0.44996 2.51256
89 2NVK NAP 0.001686 0.45161 2.52809
90 4UAL 3FV 0.001574 0.42325 2.52809
91 1PX8 XYP 0.02071 0.40832 2.52809
92 4JRB PGT 0.008094 0.40826 2.52809
93 4L7I SAM 0.004239 0.40736 2.52809
94 3MAG 3MA 0.001627 0.4987 2.60586
95 3MAG SAH 0.002526 0.40811 2.60586
96 3NGU ADP 0.00571 0.41021 2.64901
97 3D2Y AH0 ALA FGA LYS 0.000654 0.4329 2.68199
98 1Y7P RIP 0.01878 0.42661 2.69058
99 1JJ7 ADP 0.02592 0.42219 2.69231
100 3MCT 3MC 0.0004546 0.47654 2.6936
101 3MCT SAH 0.003378 0.40027 2.6936
102 3PMA SCR 0.02235 0.4023 2.7027
103 2OWZ CIT 0.0002598 0.50234 2.71084
104 2Q8M AMP 0.004058 0.42029 2.71084
105 2OWZ F6P 0.004012 0.40825 2.71084
106 2VHJ ADP 0.001329 0.41789 2.71903
107 1H5T TYD 0.02162 0.4076 2.73038
108 1H5R THM 0.03578 0.40008 2.73038
109 3UEC ALA ARG TPO LYS 0.001379 0.47577 2.73973
110 2JFV FLC 0.01293 0.42288 2.74914
111 1T3D CYS 0.0004216 0.50071 2.76817
112 3I6B KDO 0.008712 0.42033 2.77778
113 1QDS PGA 0.0002802 0.47269 2.78884
114 2Q8H TF4 0.001386 0.49258 2.80899
115 3CF6 SP1 0.000464 0.44761 2.80899
116 4RJK PYR 0.01307 0.43458 2.80899
117 1T10 F6P 0.008265 0.42647 2.80899
118 1YHM AHD 0.009409 0.42391 2.80899
119 4QCK ASD 0.0003641 0.41803 2.80899
120 3MTW M3R 0.00692 0.40312 2.80899
121 2R5T ANP 0.002881 0.40264 2.80899
122 2ZYF AKG 0.01848 0.40164 2.80899
123 1MQ0 BRD 0.000263 0.46225 2.85714
124 4JEJ 1GP 0.00179 0.43454 2.86885
125 4W6Z ETF 0.03141 0.42134 2.88184
126 1O68 KIV 0.0007437 0.46718 2.90909
127 1UXG NAD 0.0006985 0.40302 2.91262
128 1UXG FUM 0.0006985 0.40302 2.91262
129 2B7N NTM 0.0007402 0.47391 2.9304
130 3LM9 ADP 0.00901 0.40639 2.98013
131 4B9E FAH 0.003892 0.45393 2.99003
132 2EB5 OXL 0.002434 0.45689 2.99625
133 3W54 RNB 0.002442 0.42458 3.03951
134 2QCX PF1 0.01213 0.41889 3.04183
135 1G8S MET 0.000292 0.49997 3.04348
136 2Q3M MLA 0.04163 0.41482 3.06748
137 4NAO AKG 0.03438 0.40778 3.06748
138 2Q1A 2KT 0.003339 0.45046 3.07167
139 4E28 0MZ 0.007239 0.42908 3.07692
140 4E28 9MZ 0.01355 0.42193 3.07692
141 2CE7 ADP 0.000205 0.46647 3.08989
142 1OYB FMN 0.00006721 0.44927 3.08989
143 4IHQ ADP 0.003036 0.43506 3.08989
144 3CQ5 PMP 0.003481 0.43254 3.08989
145 4C6F NCD 0.002708 0.4321 3.08989
146 4C6F DOR 0.002708 0.4321 3.08989
147 1OYB HBA 0.000137 0.42744 3.08989
148 1WDN GLN 0.01992 0.41712 3.09735
149 4DFU QUE 0.0372 0.40285 3.10559
150 1KYV RBF 0.005995 0.4018 3.14465
151 3WCS MAN NAG GAL 0.003119 0.42957 3.14961
152 3WCS MAN NAG 0.01348 0.41199 3.14961
153 1TDF FAD 0.001082 0.40587 3.16456
154 1TDF NAP 0.003961 0.40429 3.16456
155 3F8C HT1 0.0132 0.41724 3.1746
156 3QP4 HL0 0.003432 0.41468 3.2967
157 1LL2 UPG 0.0001603 0.44551 3.3033
158 2Q37 3AL 0.005993 0.4328 3.31492
159 3KMT SAH 0.0004267 0.45408 3.36134
160 1KC7 PPR 0.004793 0.44954 3.37079
161 3ZPG 5GP 0.01107 0.44526 3.37079
162 3QO8 SSA 0.0006007 0.44336 3.37079
163 2Z9V PXM 0.004057 0.43491 3.37079
164 4QVH FLC 0.04465 0.42961 3.37079
165 4WVH ASP HIS ASP ALA HIS ALA 0.01099 0.41128 3.37079
166 3KV4 OGA 0.03458 0.40993 3.37079
167 2PTR 2SA 0.0006717 0.40648 3.37079
168 2VPR TDC 0.003594 0.41392 3.38164
169 4B16 NAG 0.0006358 0.52099 3.38346
170 1T57 FMN 0.00005128 0.4019 3.39806
171 1CTU ZEB 0.004525 0.40632 3.40136
172 1X8X TYR 0.003705 0.42648 3.41615
173 3OCZ SRA 0.001377 0.42539 3.43511
174 1VE3 SAM 0.003814 0.40536 3.52423
175 1ZZ7 S0H 0.00112 0.4594 3.53535
176 3SCH TB6 0.01677 0.41757 3.53535
177 3I0O ADP 0.01592 0.4003 3.53982
178 1UF5 CDT 0.01128 0.4065 3.63036
179 1YBH P22 0.0002848 0.4724 3.65169
180 1RYD GLC 0.001942 0.46148 3.65169
181 1FBL HTA 0.0006748 0.45697 3.65169
182 3DGB MUC 0.001464 0.43802 3.65169
183 3UN3 G16 0.03949 0.42098 3.65169
184 3NKS ACJ 0.004552 0.41003 3.65169
185 1IM8 SAI 0.00275 0.40333 3.68852
186 1Q6O LG6 0.0004858 0.44685 3.7037
187 1UAY ADN 0.002926 0.42153 3.71901
188 1POC GEL 0.001771 0.42135 3.73134
189 3L6R MLI 0.001263 0.47762 3.75723
190 2HFK E4H 0.00002922 0.52871 3.76176
191 2UZ2 BTN 0.002079 0.42293 3.84615
192 1CBF SAH 0.002503 0.41988 3.85965
193 1SS4 GSH 0.0001293 0.57806 3.92157
194 1GPJ CIT 0.001173 0.47172 3.93258
195 2Q09 DI6 0.001074 0.45423 3.93258
196 4DYO SD4 0.001472 0.44842 3.93258
197 2BH9 NAP 0.0005418 0.44506 3.93258
198 1WDA BAG 0.00198 0.44295 3.93258
199 4HA6 PXM 0.003759 0.44198 3.93258
200 4LHM AZZ 0.01729 0.4119 3.93258
201 2YFT DQR 0.005435 0.40711 3.93258
202 2AWN ADP 0.04056 0.40298 3.93258
203 3FXU TSU 0.001107 0.40628 3.93443
204 4GO7 THR 0.003079 0.4298 4
205 2JBH 5GP 0.006219 0.42182 4
206 4MN7 SME 0.02132 0.41162 4.02685
207 3NNF AKG 0.0009483 0.47604 4.06977
208 2WGC SIA GAL BGC 0.009756 0.4652 4.09357
209 1WGC SIA GAL BGC 0.009744 0.45617 4.09357
210 1M0S CIT 0.02542 0.41157 4.10959
211 1NU4 MLA 0.0006437 0.53281 4.12371
212 2DVZ GLU 0.002538 0.43326 4.14013
213 1B55 4IP 0.000644 0.44712 4.14201
214 2D0V PQQ 0.0005644 0.43092 4.16667
215 1L3I SAH 0.0006702 0.40651 4.16667
216 2HNK SAH 0.003666 0.40244 4.1841
217 4PTZ FMN 0.0005934 0.43887 4.18848
218 1T0I FMN 0.001317 0.42197 4.18848
219 4JCA CIT 0.0018 0.4963 4.19162
220 3NOJ PYR 0.003947 0.43817 4.20168
221 3NCQ ATP 0.001332 0.4141 4.20168
222 3IHB TRS 0.00003012 0.66051 4.21348
223 1PEA ACM 0.0001231 0.53658 4.21348
224 2YIV YIV 0.0009926 0.49099 4.21348
225 3IHB GLU 0.002272 0.46526 4.21348
226 1P9B HDA 0.001209 0.46428 4.21348
227 2YIV NBN 0.002436 0.46379 4.21348
228 3L24 GOA 0.02019 0.4315 4.21348
229 3GTD MLI 0.007476 0.42845 4.21348
230 1P9B GDP 0.001836 0.42078 4.21348
231 1P9B IMO 0.00096 0.40825 4.21348
232 2CJH AKG 0.007359 0.40211 4.21348
233 3LE7 ADE 0.03964 0.4058 4.21456
234 3SJ0 DXC 0.009078 0.43606 4.22535
235 1Y2W NAG 0.02641 0.40825 4.22535
236 1ZJ6 G3D 0.009397 0.40565 4.27807
237 3SHR CMP 0.0003876 0.46689 4.34783
238 3CEV ARG 0.01675 0.40346 4.34783
239 3R51 MMA 0.002414 0.47996 4.375
240 1MXI SAH 0.004112 0.40418 4.375
241 1C1L GAL BGC 0.02753 0.41253 4.37956
242 1A5V Y3 0.01057 0.42162 4.43038
243 2VAR KDF 0.0005708 0.4544 4.47284
244 2VAR AMP 0.003671 0.42665 4.47284
245 2VAR ANP 0.001006 0.41826 4.47284
246 2VAR KDG 0.00647 0.41216 4.47284
247 1HYE NAP 0.001049 0.41042 4.47284
248 3O2K QRP 0.0002912 0.472 4.49438
249 4CCN OGA 0.005517 0.44025 4.49438
250 4CCO OGA 0.006794 0.42508 4.49438
251 1E2S CSN 0.002921 0.42155 4.49438
252 2RHQ GAX 0.001937 0.40507 4.49438
253 3O2K DST 0.02055 0.40391 4.49438
254 2JAR UMP 0.001255 0.42272 4.5
255 3U1T MLI 0.01019 0.43361 4.53074
256 3SIX GDP 0.008387 0.40764 4.54545
257 1OGD RIP 0.009689 0.4183 4.58015
258 1Q3P GLU ALA GLN THR ARG LEU 0.003862 0.41274 4.58716
259 1EP2 FMN 0.0002947 0.41393 4.5977
260 1FX8 BOG 0.00483 0.40527 4.62633
261 3K3K A8S 0.003261 0.40422 4.73934
262 1QH9 LAC 0.00366 0.4486 4.74138
263 4M5P MLA 0.001114 0.50769 4.77528
264 4M5P 23W 0.002767 0.46859 4.77528
265 4KCT PYR 0.002314 0.44008 4.77528
266 2PUL ACP 0.001357 0.42995 4.77528
267 4KCT FDP 0.006189 0.41294 4.77528
268 1TFZ 869 0.001842 0.41292 4.77528
269 1I2B NAD 0.01568 0.40263 4.77528
270 1I2B UPG 0.01568 0.40263 4.77528
271 1I2B USQ 0.01568 0.40263 4.77528
272 1DXY COI 0.0002652 0.53016 4.8048
273 4FGC PQ0 0.002108 0.45335 4.84848
274 2W3L DRO 0.047 0.412 4.86111
275 1V35 NAI 0.0004228 0.41281 4.86322
276 1U5R ATP 0.001491 0.42841 4.88506
277 1Y1A GSH 0.02068 0.44811 4.91803
278 3ZUY TCH 0.009102 0.41036 4.95356
279 1YOA FMN 0.005299 0.48041 5.03145
280 1H16 PYR 0.0004264 0.50945 5.05618
281 2ZWS PLM 0.00301 0.49448 5.05618
282 1H16 DTL 0.0209 0.43072 5.05618
283 1E5F PLP 0.002453 0.42021 5.05618
284 1KYZ SAH 0.003106 0.40857 5.05618
285 1G6H ADP 0.02538 0.42233 5.05837
286 1I0Z OXM 0.0133 0.44108 5.1051
287 1NP0 NGT 0.02132 0.41264 5.17241
288 1WRA PC 0.005806 0.44549 5.19481
289 4R3L COA 0.001554 0.42556 5.20231
290 1XIU REA 0.001032 0.43001 5.21739
291 5EQU AKG 0.04156 0.40901 5.2459
292 4COQ SAN 0.001359 0.46873 5.26316
293 4LO6 SIA GAL 0.01962 0.42261 5.26316
294 3O7B SAH 0.001176 0.42374 5.32787
295 3T1A 5MA 0.0003157 0.44426 5.33708
296 3A1I UNU 0.002696 0.43218 5.33708
297 2QV7 ADP 0.0008515 0.43762 5.34125
298 1VBO MAN 0.01128 0.43324 5.36913
299 1EYQ NAR 0.004931 0.42611 5.40541
300 2C2A ADP 0.002524 0.41568 5.42636
301 1AX2 NDG GAL 0.002096 0.44747 5.43933
302 1DBT U5P 0.002611 0.41128 5.43933
303 1B74 DGN 0.0006641 0.49977 5.51181
304 1MZV AMP 0.002666 0.43238 5.53191
305 3I51 45C 0.0001757 0.47488 5.55556
306 1F1V DHY 0.003082 0.43479 5.57276
307 2FJK 13P 0.0107 0.42689 5.57377
308 1QO0 BMD 0.004084 0.44637 5.61225
309 2OKK ABU 0.00944 0.44173 5.61798
310 2PP3 LGT 0.00332 0.41939 5.61798
311 4AMV F6R 0.004698 0.40951 5.61798
312 1NXJ TLA 0.006228 0.403 5.61798
313 4Q0A GLY HIS LYS ILE LEU HIS ARG LEU LEU GLN 0.001776 0.4173 5.62914
314 2OHV NHL 0.002269 0.44044 5.68182
315 1U3I GSH 0.02216 0.40697 5.6872
316 3AB4 THR 0.02908 0.40471 5.70071
317 1JGS SAL 0.0009586 0.52292 5.7971
318 1NF8 ISC 0.002525 0.42855 5.7971
319 1NF8 BOG 0.01324 0.42808 5.7971
320 1E4E ADP 0.001562 0.41931 5.8309
321 2P69 PLP 0.005856 0.43326 5.88235
322 2Q28 ADP 0.0002964 0.44072 5.89888
323 3M31 FAD 0.0006316 0.41759 5.89888
324 1Y75 NAG 0.001289 0.45087 5.9322
325 2FOI JPA 0.003409 0.42798 5.94796
326 1L2T ATP 0.001799 0.40279 5.95745
327 2VQ5 HBA 0.002151 0.46642 5.97015
328 2VQ5 LDP 0.01404 0.43984 5.97015
329 1JAC AMG 0.007123 0.46363 6.01504
330 1NNS ASP 0.007443 0.41397 6.13497
331 2DWU DGL 0.0002813 0.47893 6.15942
332 1C7S CBS 0.0008192 0.44812 6.17978
333 3TFC PEP 0.00268 0.4428 6.17978
334 3PC3 P1T 0.0006828 0.42401 6.17978
335 2ZO9 MLI 0.01031 0.40605 6.20438
336 1A27 EST 0.001689 0.42635 6.22837
337 1UW1 ADP 0.003233 0.44495 6.25
338 1Y9Q MED 0.004421 0.44476 6.25
339 3W8S GSH 0.007205 0.42918 6.31068
340 4AF5 CIT 0.005916 0.43883 6.31579
341 2XNJ FAD 0.004839 0.43701 6.39098
342 2ORV 4TA 0.0001033 0.43903 6.41026
343 4WNB 4BN 0.0059 0.40206 6.41711
344 1N9L FMN 0.0002713 0.44663 6.42202
345 4JWX 1N4 0.004534 0.43279 6.42857
346 4L6C 0BT 0.0002811 0.43303 6.43564
347 1LYX PGA 0.0004218 0.45427 6.45161
348 1V6A TRE 0.0001925 0.50035 6.46067
349 3ZGE ASP 0.002114 0.47447 6.46067
350 4WBD CIT 0.003154 0.46573 6.46067
351 4WBD ADP 0.005963 0.44493 6.46067
352 1FW1 GSH 0.003179 0.42012 6.48148
353 4B4D FAD 0.002011 0.40798 6.48855
354 3PNA CMP 0.0002663 0.47993 6.49351
355 1WHT BZS 0.008669 0.43104 6.53595
356 1UFY MLI 0.03611 0.40179 6.55738
357 1QR0 COA 0.003219 0.429 6.57895
358 1BTN I3P 0.0004185 0.54621 6.60377
359 1NYT NAP 0.0003064 0.42036 6.64207
360 3EW2 BTN 0.0005255 0.46741 6.66667
361 2O66 FLC 0.001918 0.45521 6.66667
362 1SC3 MLI 0.0005559 0.50366 6.74157
363 3K5X P8D 0.001282 0.44549 6.74157
364 3GAY P6T 0.01237 0.40271 6.81115
365 4Q3F TLA 0.03617 0.40175 6.83761
366 3ZF8 GDP 0.001045 0.44915 6.88525
367 3LST SAH 0.007004 0.40674 6.89655
368 3GM5 CIT 0.02029 0.41366 6.91824
369 9LDB OXM 0.001895 0.49509 6.92771
370 9LDT OXM 0.00968 0.45633 6.92771
371 1C3V PDC 0.002662 0.44877 6.93878
372 1TUV VK3 0.0299 0.42247 7.01754
373 3BK2 U5P 0.001379 0.43906 7.02247
374 1Y42 TYR 0.003503 0.4377 7.02247
375 1O0S NAI 0.0005794 0.41881 7.02247
376 2RL1 UD1 0.001062 0.40358 7.02247
377 1QD0 RR6 0.004938 0.41687 7.03125
378 3BY8 MLT 0.003391 0.45683 7.04225
379 4NPT 017 0.00458 0.42268 7.07071
380 1SQ5 PAU 0.000682 0.46883 7.14286
381 1SQ5 ADP 0.001003 0.44461 7.14286
382 3BRE C2E 0.0001927 0.50841 7.30337
383 3DG6 MUC 0.0009056 0.44136 7.30337
384 1Z42 HBA 0.01945 0.44958 7.39645
385 1Z44 FMN 0.0009478 0.44059 7.39645
386 1Z48 FMN 0.0009729 0.43543 7.39645
387 1Z41 FMN 0.001216 0.43176 7.39645
388 1Z44 NPO 0.04436 0.42716 7.39645
389 1Z42 FMN 0.003073 0.42513 7.39645
390 4JLV ADP 0.03119 0.43207 7.43494
391 2WK1 SAH 0.0003071 0.43587 7.44681
392 1P4V GLY 0.0332 0.41059 7.45763
393 1H5S TMP 0.01019 0.42003 7.50853
394 3SQG COM 0.001265 0.50468 7.52688
395 3QP6 HL6 0.0004282 0.45402 7.54717
396 2BES RES 0.01083 0.40318 7.55814
397 2NCD ADP 0.00211 0.45333 7.58427
398 1RYI GOA 0.01082 0.45982 7.59162
399 1JN2 SFP 0.01076 0.48309 7.59494
400 2PFC PLM 0.0096 0.40528 7.65027
401 3CH5 GDP 0.001996 0.43264 7.69231
402 1I1Q TRP 0.003168 0.43428 7.8125
403 2IZ1 ATR 0.0008085 0.47928 7.86517
404 3PLN U5P 0.02508 0.40008 7.86517
405 4F4S EFO 0.003061 0.44027 7.89474
406 2CBZ ATP 0.02364 0.42353 8.01688
407 1R6W 164 0.004312 0.41092 8.07453
408 2Y6P CTP 0.001747 0.43995 8.11966
409 4EPL JAI 0.0005123 0.44598 8.14607
410 1QPB TPP 0.0004752 0.41105 8.14607
411 2YVF NAD 0.00189 0.4092 8.14607
412 2R42 FPS 0.003934 0.40136 8.14607
413 2XI7 XI7 0.001441 0.51279 8.15217
414 3BHO B4P 0.01485 0.44613 8.17308
415 3F81 STT 0.01443 0.43921 8.19672
416 3LTW HLZ 0.002767 0.45428 8.21429
417 2PR5 FMN 0.0005105 0.43676 8.33333
418 2XDQ MGX 0.002466 0.47948 8.42697
419 3M6W SAM 0.007621 0.40153 8.42697
420 1S8F GDP 0.001442 0.43349 8.47458
421 3PMD 11A 0.004348 0.42362 8.49673
422 1RL4 BL5 0.01787 0.42765 8.51064
423 5D63 FUC GLA GLA 0.009057 0.43015 8.53242
424 5D63 FUC GAL GLA 0.00565 0.4236 8.53242
425 1I2L DCS 0.002083 0.41105 8.55019
426 5RHN 8BR 0.002044 0.42321 8.69565
427 3TKA CTN 0.0002704 0.5584 8.70786
428 3TKA SAM 0.000349 0.43397 8.70786
429 3KMZ EQO 0.0004303 0.41235 8.70786
430 2OAT PFM 0.006187 0.40129 8.70786
431 2JL1 NAP 0.001259 0.41131 8.7108
432 3VPQ GSH 0.01275 0.41792 8.82353
433 4EXO PYR 0.0002663 0.51973 8.90411
434 1V7R CIT 0.02715 0.43167 9.13978
435 1H8P PC 0.0005679 0.51286 9.17431
436 1ECM TSA 0.0001583 0.48952 9.17431
437 2QF7 COA 0.004432 0.4145 9.26966
438 2WCV FUC 0.000818 0.45925 9.28571
439 3RGG AIR 0.0092 0.41017 9.43396
440 3KJQ B94 0.004051 0.42032 9.47368
441 2RCN GDP 0.003777 0.42614 9.55056
442 2FR6 URI 0.0003254 0.44379 9.58904
443 2FR6 CTN 0.0005082 0.43683 9.58904
444 2Y7P SAL 0.003308 0.43879 9.63303
445 1SJW NGV 0.00518 0.4079 9.72222
446 2X2T GAL NGA 0.006339 0.45798 9.80392
447 4M37 SAH 0.001575 0.41531 9.91254
448 1YRX FMN 0.001387 0.43416 9.91736
449 1XX4 BAM 0.006616 0.45701 9.96169
450 3GX0 GDS 0.001786 0.41339 10.2326
451 4F8L GAL 0.003182 0.4931 10.3448
452 1QY1 PRZ 0.001765 0.40991 10.3448
453 2GJN FMN 0.0001381 0.43111 10.3659
454 2GJN NIS 0.0005451 0.406 10.3659
455 1HFA PIO 0.01221 0.43957 10.3806
456 4O8A 2OP 0.002816 0.47646 10.3933
457 1ZED PNP 0.04617 0.40145 10.3933
458 1H8G CHT 0.03672 0.43195 10.5263
459 1WNG SAH 0.001182 0.41967 10.566
460 2Y7G AAE 0.003286 0.4154 10.6383
461 3KYF 5GP 5GP 0.002224 0.43563 10.8225
462 2XCM ADP 0.0211 0.40463 10.8696
463 2HEK GDP 0.001717 0.44026 10.9551
464 2C7G FAD 0.002031 0.40446 10.9551
465 2BZ1 TAU 0.005594 0.47907 11.7347
466 1I36 NAP 0.002127 0.40371 11.7424
467 1Z45 GAL 0.008243 0.42139 11.7978
468 2ZJF BSU 0.007024 0.41501 11.7978
469 4G4S LDZ 0.00552 0.40312 11.8056
470 1ULE GLA GAL NAG 0.002481 0.47097 12
471 1PTR PRB 0.00294 0.45983 12
472 2QLX RM4 0.00353 0.45598 12.037
473 2F2U M77 0.001548 0.44211 12.0787
474 1K6M AGS 0.002566 0.40099 12.0787
475 4WX0 HXD 0.0002612 0.45705 12.1673
476 2YLD CMO 0.008483 0.43148 12.5984
477 2ZJ5 ADP 0.004496 0.43846 12.9213
478 1SJD NPG 0.001341 0.40362 12.9213
479 1VQ2 DDN 0.005801 0.40233 12.9534
480 1TH8 ADP 0.001289 0.44539 13.7931
481 1EYE PMM 0.002769 0.42695 13.9286
482 1UOU CMU 0.002934 0.42148 14.0449
483 1JH7 UVC 0.02623 0.40362 14.2857
484 4K30 NLG 0.009145 0.41941 14.375
485 1NVV GNP 0.0007121 0.40898 14.4578
486 1NVU GTP 0.002339 0.40177 14.4578
487 2IYG FMN 0.0006992 0.45088 14.5161
488 3E81 SLB 0.003363 0.44417 14.6341
489 3RF4 FUN 0.006299 0.42652 14.6552
490 1LNX URI 0.001957 0.44878 14.8148
491 2HW1 FRU 0.001252 0.46359 15.1007
492 2HW1 ANP 0.001337 0.41404 15.1007
493 2H6T IVA VAL VAL STA ALA STA 0.0005843 0.43912 15.2941
494 2V5E SCR 0.005798 0.46853 15.8416
495 2J5S KTA 0.002839 0.40998 17.1103
496 3MD0 GDP 0.009895 0.41323 18.0282
497 1WKL ADP 0.002591 0.4114 18.2482
498 2HV8 GTP 0.0005329 0.41637 18.75
499 2O2C G6Q 0.002038 0.42326 19.6629
500 3S9K CIT 0.001981 0.50448 20.339
501 1T0S BML 0.002727 0.46891 20.9302
502 2BOI MFU 0.0006006 0.47124 23.0089
503 2FYU FDN 0.0003333 0.44341 24.1935
504 1UO5 PIH 0.002777 0.49649 29.4118
505 1UO4 PIH 0.002226 0.49126 29.4118
506 2P8O BVA 0.004017 0.40823 46.1538
Pocket No.: 2; Query (leader) PDB : 4KQI; Ligand: NIO; Similar sites found: 484
This union binding pocket(no: 2) in the query (biounit: 4kqi.bio1) has 45 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1B5E DCM 0.000264 0.4801 None
2 3T2W BTN 0.000447 0.46434 None
3 2E1A MSE 0.0008755 0.458 None
4 4N7C AEF 0.003893 0.45392 None
5 4KGM ATP 0.001266 0.44056 None
6 2OFD NGA 0.01045 0.42723 None
7 2OFE NAG 0.02789 0.40712 None
8 2YDW WSH 0.01367 0.40305 None
9 4HZO COA 0.0008373 0.46493 0.943396
10 3B1F NAD 0.002393 0.402 1.03448
11 1VDC FAD 0.001327 0.40414 1.2012
12 2BO4 FLC 0.004625 0.45029 1.40449
13 1VJO PLP 0.005989 0.40551 1.40449
14 1NHZ 486 0.0009444 0.41548 1.42857
15 4OB6 S2T 0.00006641 0.47957 1.46628
16 4USS GSH 0.01875 0.40567 1.53846
17 3P7I P7I 0.00911 0.41948 1.55763
18 2VDJ HSE 0.004034 0.46035 1.66113
19 1GJW GLC 0.001393 0.47556 1.68539
20 1Q11 TYE 0.000821 0.4653 1.68539
21 3HZL 6PC 0.009401 0.449 1.68539
22 1GJW MAL 0.001547 0.44213 1.68539
23 1KTC NGA 0.003727 0.43652 1.68539
24 1H0C AOA 0.01452 0.42611 1.68539
25 2GWD GLU 0.005668 0.42354 1.68539
26 4C2G ALA ALA ALA ALA 0.005675 0.42351 1.68539
27 4M51 BEZ 0.02657 0.41894 1.68539
28 3VCA PRO 0.02006 0.40661 1.68539
29 2Y0I AKG 0.009591 0.42354 1.70455
30 4OJ8 AKG 0.001151 0.42008 1.70648
31 4B7E OGA 0.004774 0.43728 1.7192
32 2WA4 069 0.003456 0.42309 1.7192
33 3P3N AKG 0.01767 0.41649 1.7192
34 1H2K OGA 0.01773 0.41642 1.7192
35 1H2M OGA 0.02 0.41395 1.7192
36 3K3G MMU 0.005292 0.4325 1.76471
37 1RZM E4P 0.0002285 0.5136 1.77515
38 1RZM PEP 0.01906 0.40535 1.77515
39 1P72 THM 0.001939 0.44896 1.79641
40 1NML CIT 0.0007772 0.46634 1.84049
41 2F59 INI 0.002561 0.41158 1.91083
42 1SG4 CO8 0.0005986 0.408 1.92308
43 2W8Q SIN 0.001293 0.47713 1.96629
44 4LIT AKG 0.007118 0.42942 1.96629
45 1MOQ GLP 0.001691 0.41807 1.96629
46 1P1M MET 0.001906 0.40531 1.96629
47 2P41 G1G 0.002415 0.43929 1.96721
48 4G28 0W8 0.002653 0.43755 2.01342
49 3DER ALA LYS 0.002272 0.40617 2.02899
50 3A2Y TS5 0.0002361 0.45363 2.03046
51 1Z6K OAA 0.00501 0.41882 2.04778
52 4JP3 CIT 0.007886 0.40871 2.09205
53 3QDW A2G 0.001677 0.48824 2.0979
54 3QDY A2G GAL 0.00196 0.47613 2.0979
55 3QDY CBS 0.003671 0.45516 2.0979
56 3QDT A2G GAL 0.01649 0.42947 2.0979
57 3QDW NDG 0.02012 0.4192 2.0979
58 1B63 ANP 0.0003486 0.42991 2.1021
59 2ZSC BTN 0.006285 0.40858 2.12766
60 1KYQ NAD 0.00532 0.40016 2.18978
61 3GJB AKG 0.007057 0.41948 2.19436
62 3JQ3 ADP 0.0009302 0.45123 2.24719
63 3QV9 QV7 0.003762 0.44196 2.24719
64 3B9Z CO2 0.01112 0.42595 2.24719
65 2C5S AMP 0.005816 0.42306 2.24719
66 1A59 CIT 0.02071 0.41859 2.24719
67 3I8P 840 0.003037 0.4167 2.24719
68 1A59 COA 0.002285 0.41337 2.24719
69 1SNY NAP 0.0009631 0.40173 2.24719
70 1KDK DHT 0.00005478 0.45671 2.25989
71 1FP2 HMO 0.002481 0.42003 2.27273
72 1FP2 SAH 0.009165 0.40218 2.27273
73 1O9U ADZ 0.001439 0.49173 2.28571
74 1EB9 HBA 0.002805 0.42672 2.29008
75 2A2X NA9 0.0007847 0.43005 2.3166
76 2FEQ 34P 0.00484 0.40523 2.3166
77 1M1B SPV 0.00147 0.46044 2.37288
78 4IMG NGF 0.003617 0.40264 2.38908
79 4U9W COA 0.005129 0.4043 2.41546
80 1CKM GTP 0.001329 0.41789 2.42424
81 3NFZ 3NF 0.002923 0.426 2.44648
82 3DX5 DHB 0.001353 0.44453 2.44755
83 3EE4 MYR 0.0005011 0.42861 2.47678
84 1X92 M7P 0.0007372 0.44996 2.51256
85 2NVK NAP 0.001686 0.45161 2.52809
86 4UAL 3FV 0.001574 0.42325 2.52809
87 1PX8 XYP 0.02071 0.40832 2.52809
88 4JRB PGT 0.008094 0.40826 2.52809
89 4L7I SAM 0.004239 0.40736 2.52809
90 3MAG 3MA 0.001627 0.4987 2.60586
91 3MAG SAH 0.002526 0.40811 2.60586
92 3NGU ADP 0.00571 0.41021 2.64901
93 3D2Y AH0 ALA FGA LYS 0.000654 0.4329 2.68199
94 1Y7P RIP 0.01878 0.42661 2.69058
95 3MCT 3MC 0.0004546 0.47654 2.6936
96 3MCT SAH 0.003378 0.40027 2.6936
97 3PMA SCR 0.02235 0.4023 2.7027
98 2OWZ CIT 0.0002598 0.50234 2.71084
99 2Q8M AMP 0.004058 0.42029 2.71084
100 2OWZ F6P 0.004012 0.40825 2.71084
101 2VHJ ADP 0.001329 0.41789 2.71903
102 3UEC ALA ARG TPO LYS 0.001379 0.47577 2.73973
103 2JFV FLC 0.01293 0.42288 2.74914
104 1T3D CYS 0.0004216 0.50071 2.76817
105 3I6B KDO 0.008712 0.42033 2.77778
106 1QDS PGA 0.0002802 0.47269 2.78884
107 2Q8H TF4 0.001386 0.49258 2.80899
108 3CF6 SP1 0.000464 0.44761 2.80899
109 4RJK PYR 0.01307 0.43458 2.80899
110 1T10 F6P 0.008265 0.42647 2.80899
111 1YHM AHD 0.009409 0.42391 2.80899
112 4QCK ASD 0.0003641 0.41803 2.80899
113 3MTW M3R 0.00692 0.40312 2.80899
114 2R5T ANP 0.002881 0.40264 2.80899
115 2ZYF AKG 0.01848 0.40164 2.80899
116 1MQ0 BRD 0.000263 0.46225 2.85714
117 4JEJ 1GP 0.00179 0.43454 2.86885
118 4W6Z ETF 0.03141 0.42134 2.88184
119 1O68 KIV 0.0007437 0.46718 2.90909
120 1UXG FUM 0.0006985 0.40302 2.91262
121 1UXG NAD 0.0006985 0.40302 2.91262
122 2B7N NTM 0.0007402 0.47391 2.9304
123 3LM9 ADP 0.00901 0.40639 2.98013
124 4B9E FAH 0.003892 0.45393 2.99003
125 2EB5 OXL 0.002434 0.45689 2.99625
126 3W54 RNB 0.002442 0.42458 3.03951
127 2QCX PF1 0.01213 0.41889 3.04183
128 1G8S MET 0.000292 0.49997 3.04348
129 2Q3M MLA 0.04163 0.41482 3.06748
130 4NAO AKG 0.03438 0.40778 3.06748
131 2Q1A 2KT 0.003339 0.45046 3.07167
132 4E28 0MZ 0.007239 0.42908 3.07692
133 4E28 9MZ 0.01355 0.42193 3.07692
134 2CE7 ADP 0.000205 0.46647 3.08989
135 1OYB FMN 0.00006721 0.44927 3.08989
136 4IHQ ADP 0.003036 0.43506 3.08989
137 3CQ5 PMP 0.003481 0.43254 3.08989
138 4C6F DOR 0.002708 0.4321 3.08989
139 4C6F NCD 0.002708 0.4321 3.08989
140 1OYB HBA 0.000137 0.42744 3.08989
141 1KYV RBF 0.005995 0.4018 3.14465
142 3WCS MAN NAG GAL 0.003119 0.42957 3.14961
143 3WCS MAN NAG 0.01348 0.41199 3.14961
144 1TDF FAD 0.001082 0.40587 3.16456
145 1TDF NAP 0.003961 0.40429 3.16456
146 3F8C HT1 0.0132 0.41724 3.1746
147 3QP4 HL0 0.003432 0.41468 3.2967
148 1LL2 UPG 0.0001603 0.44551 3.3033
149 2Q37 3AL 0.005993 0.4328 3.31492
150 3KMT SAH 0.0004267 0.45408 3.36134
151 2DTJ THR 0.0009034 0.45175 3.37079
152 1KC7 PPR 0.004793 0.44954 3.37079
153 3ZPG 5GP 0.01107 0.44526 3.37079
154 3QO8 SSA 0.0006007 0.44336 3.37079
155 2Z9V PXM 0.004057 0.43491 3.37079
156 4QVH FLC 0.04465 0.42961 3.37079
157 4WVH ASP HIS ASP ALA HIS ALA 0.01099 0.41128 3.37079
158 2PTR 2SA 0.0006717 0.40648 3.37079
159 2VPR TDC 0.003594 0.41392 3.38164
160 4B16 NAG 0.0006358 0.52099 3.38346
161 1T57 FMN 0.00005128 0.4019 3.39806
162 1CTU ZEB 0.004525 0.40632 3.40136
163 1X8X TYR 0.003705 0.42648 3.41615
164 3OCZ SRA 0.001377 0.42539 3.43511
165 1VE3 SAM 0.003814 0.40536 3.52423
166 1ZZ7 S0H 0.00112 0.4594 3.53535
167 3SCH TB6 0.01677 0.41757 3.53535
168 3I0O ADP 0.01592 0.4003 3.53982
169 1UF5 CDT 0.01128 0.4065 3.63036
170 1YBH P22 0.0002848 0.4724 3.65169
171 1RYD GLC 0.001942 0.46148 3.65169
172 1FBL HTA 0.0006748 0.45697 3.65169
173 3DGB MUC 0.001464 0.43802 3.65169
174 3NKS ACJ 0.004552 0.41003 3.65169
175 1IM8 SAI 0.00275 0.40333 3.68852
176 1Q6O LG6 0.0004858 0.44685 3.7037
177 1UAY ADN 0.002926 0.42153 3.71901
178 1POC GEL 0.001771 0.42135 3.73134
179 3L6R MLI 0.001263 0.47762 3.75723
180 2HFK E4H 0.00002922 0.52871 3.76176
181 2UZ2 BTN 0.002079 0.42293 3.84615
182 1CBF SAH 0.002503 0.41988 3.85965
183 1SS4 GSH 0.0001293 0.57806 3.92157
184 1GPJ CIT 0.001173 0.47172 3.93258
185 2Q09 DI6 0.001074 0.45423 3.93258
186 4DYO SD4 0.001472 0.44842 3.93258
187 2BH9 NAP 0.0005418 0.44506 3.93258
188 1WDA BAG 0.00198 0.44295 3.93258
189 4HA6 PXM 0.003759 0.44198 3.93258
190 4LHM AZZ 0.01729 0.4119 3.93258
191 2YFT DQR 0.005435 0.40711 3.93258
192 3FXU TSU 0.001107 0.40628 3.93443
193 4GO7 THR 0.003079 0.4298 4
194 2JBH 5GP 0.006219 0.42182 4
195 3NNF AKG 0.0009483 0.47604 4.06977
196 2WGC SIA GAL BGC 0.009756 0.4652 4.09357
197 1WGC SIA GAL BGC 0.009744 0.45617 4.09357
198 1NU4 MLA 0.0006437 0.53281 4.12371
199 2DVZ GLU 0.002538 0.43326 4.14013
200 1B55 4IP 0.000644 0.44712 4.14201
201 2D0V PQQ 0.0005644 0.43092 4.16667
202 1L3I SAH 0.0006702 0.40651 4.16667
203 2HNK SAH 0.003666 0.40244 4.1841
204 4PTZ FMN 0.0005934 0.43887 4.18848
205 1T0I FMN 0.001317 0.42197 4.18848
206 4JCA CIT 0.0018 0.4963 4.19162
207 3NOJ PYR 0.003947 0.43817 4.20168
208 3NCQ ATP 0.001332 0.4141 4.20168
209 3IHB TRS 0.00003012 0.66051 4.21348
210 1PEA ACM 0.0001231 0.53658 4.21348
211 2YIV YIV 0.0009926 0.49099 4.21348
212 3IHB GLU 0.002272 0.46526 4.21348
213 1P9B HDA 0.001209 0.46428 4.21348
214 2YIV NBN 0.002436 0.46379 4.21348
215 3L24 GOA 0.02019 0.4315 4.21348
216 3GTD MLI 0.007476 0.42845 4.21348
217 1P9B GDP 0.001836 0.42078 4.21348
218 1P9B IMO 0.00096 0.40825 4.21348
219 2CJH AKG 0.007359 0.40211 4.21348
220 3SJ0 DXC 0.009078 0.43606 4.22535
221 1Y2W NAG 0.02641 0.40825 4.22535
222 1ZJ6 G3D 0.009397 0.40565 4.27807
223 3SHR CMP 0.0003876 0.46689 4.34783
224 3CEV ARG 0.01675 0.40346 4.34783
225 3R51 MMA 0.002414 0.47996 4.375
226 1MXI SAH 0.004112 0.40418 4.375
227 1C1L GAL BGC 0.02753 0.41253 4.37956
228 1A5V Y3 0.01057 0.42162 4.43038
229 2VAR KDF 0.0005708 0.4544 4.47284
230 2VAR AMP 0.003671 0.42665 4.47284
231 2VAR ANP 0.001006 0.41826 4.47284
232 2VAR KDG 0.00647 0.41216 4.47284
233 1HYE NAP 0.001049 0.41042 4.47284
234 3O2K QRP 0.0002912 0.472 4.49438
235 4CCN OGA 0.005517 0.44025 4.49438
236 4CCO OGA 0.006794 0.42508 4.49438
237 1E2S CSN 0.002921 0.42155 4.49438
238 2RHQ GAX 0.001937 0.40507 4.49438
239 3O2K DST 0.02055 0.40391 4.49438
240 2JAR UMP 0.001255 0.42272 4.5
241 3U1T MLI 0.01019 0.43361 4.53074
242 3SIX GDP 0.008387 0.40764 4.54545
243 1OGD RIP 0.009689 0.4183 4.58015
244 1Q3P GLU ALA GLN THR ARG LEU 0.003862 0.41274 4.58716
245 1EP2 FMN 0.0002947 0.41393 4.5977
246 1FX8 BOG 0.00483 0.40527 4.62633
247 3K3K A8S 0.003261 0.40422 4.73934
248 1QH9 LAC 0.00366 0.4486 4.74138
249 4M5P MLA 0.001114 0.50769 4.77528
250 4M5P 23W 0.002767 0.46859 4.77528
251 4KCT PYR 0.002314 0.44008 4.77528
252 2PUL ACP 0.001357 0.42995 4.77528
253 4KCT FDP 0.006189 0.41294 4.77528
254 1TFZ 869 0.001842 0.41292 4.77528
255 1I2B USQ 0.01568 0.40263 4.77528
256 1I2B NAD 0.01568 0.40263 4.77528
257 1I2B UPG 0.01568 0.40263 4.77528
258 1DXY COI 0.0002652 0.53016 4.8048
259 4FGC PQ0 0.002108 0.45335 4.84848
260 2W3L DRO 0.047 0.412 4.86111
261 1V35 NAI 0.0004228 0.41281 4.86322
262 1U5R ATP 0.001491 0.42841 4.88506
263 1Y1A GSH 0.02068 0.44811 4.91803
264 3ZUY TCH 0.009102 0.41036 4.95356
265 1YOA FMN 0.005299 0.48041 5.03145
266 1H16 PYR 0.0004264 0.50945 5.05618
267 2ZWS PLM 0.00301 0.49448 5.05618
268 1H16 DTL 0.0209 0.43072 5.05618
269 1E5F PLP 0.002453 0.42021 5.05618
270 1KYZ SAH 0.003106 0.40857 5.05618
271 3RK0 AMP 0.000542 0.4553 5.06329
272 1I0Z OXM 0.0133 0.44108 5.1051
273 1NP0 NGT 0.02132 0.41264 5.17241
274 1WRA PC 0.005806 0.44549 5.19481
275 4R3L COA 0.001554 0.42556 5.20231
276 1XIU REA 0.001032 0.43001 5.21739
277 5EQU AKG 0.04156 0.40901 5.2459
278 4COQ SAN 0.001359 0.46873 5.26316
279 4LO6 SIA GAL 0.01962 0.42261 5.26316
280 3O7B SAH 0.001176 0.42374 5.32787
281 3T1A 5MA 0.0003157 0.44426 5.33708
282 3A1I UNU 0.002696 0.43218 5.33708
283 2QV7 ADP 0.0008515 0.43762 5.34125
284 1EYQ NAR 0.004931 0.42611 5.40541
285 2C2A ADP 0.002524 0.41568 5.42636
286 1AX2 NDG GAL 0.002096 0.44747 5.43933
287 1DBT U5P 0.002611 0.41128 5.43933
288 1B74 DGN 0.0006641 0.49977 5.51181
289 1MZV AMP 0.002666 0.43238 5.53191
290 3I51 45C 0.0001757 0.47488 5.55556
291 1F1V DHY 0.003082 0.43479 5.57276
292 1QO0 BMD 0.004084 0.44637 5.61225
293 2OKK ABU 0.00944 0.44173 5.61798
294 2PP3 LGT 0.00332 0.41939 5.61798
295 4AMV F6R 0.004698 0.40951 5.61798
296 1NXJ TLA 0.006228 0.403 5.61798
297 4Q0A GLY HIS LYS ILE LEU HIS ARG LEU LEU GLN 0.001776 0.4173 5.62914
298 2OHV NHL 0.002269 0.44044 5.68182
299 1U3I GSH 0.02216 0.40697 5.6872
300 1BGQ RDC 0.00005237 0.41374 5.77778
301 1JGS SAL 0.0009586 0.52292 5.7971
302 1NF8 ISC 0.002525 0.42855 5.7971
303 1NF8 BOG 0.01324 0.42808 5.7971
304 1E4E ADP 0.001562 0.41931 5.8309
305 2P69 PLP 0.005856 0.43326 5.88235
306 2Q28 ADP 0.0002964 0.44072 5.89888
307 3M31 FAD 0.0006316 0.41759 5.89888
308 1Y75 NAG 0.001289 0.45087 5.9322
309 2FOI JPA 0.003409 0.42798 5.94796
310 1L2T ATP 0.001799 0.40279 5.95745
311 2VQ5 HBA 0.002151 0.46642 5.97015
312 2VQ5 LDP 0.01404 0.43984 5.97015
313 1JAC AMG 0.007123 0.46363 6.01504
314 1NNS ASP 0.007443 0.41397 6.13497
315 2DWU DGL 0.0002813 0.47893 6.15942
316 1C7S CBS 0.0008192 0.44812 6.17978
317 3TFC PEP 0.00268 0.4428 6.17978
318 3PC3 P1T 0.0006828 0.42401 6.17978
319 2ZO9 MLI 0.01031 0.40605 6.20438
320 1A27 EST 0.001689 0.42635 6.22837
321 1UW1 ADP 0.003233 0.44495 6.25
322 1Y9Q MED 0.004421 0.44476 6.25
323 3W8S GSH 0.007205 0.42918 6.31068
324 4AF5 CIT 0.005916 0.43883 6.31579
325 2XNJ FAD 0.004839 0.43701 6.39098
326 2ORV 4TA 0.0001033 0.43903 6.41026
327 4WNB 4BN 0.0059 0.40206 6.41711
328 1N9L FMN 0.0002713 0.44663 6.42202
329 4JWX 1N4 0.004534 0.43279 6.42857
330 4L6C 0BT 0.0002811 0.43303 6.43564
331 1LYX PGA 0.0004218 0.45427 6.45161
332 1V6A TRE 0.0001925 0.50035 6.46067
333 3ZGE ASP 0.002114 0.47447 6.46067
334 4WBD CIT 0.003154 0.46573 6.46067
335 4WBD ADP 0.005963 0.44493 6.46067
336 1FW1 GSH 0.003179 0.42012 6.48148
337 4B4D FAD 0.002011 0.40798 6.48855
338 3PNA CMP 0.0002663 0.47993 6.49351
339 1WHT BZS 0.008669 0.43104 6.53595
340 1UFY MLI 0.03611 0.40179 6.55738
341 1QR0 COA 0.003219 0.429 6.57895
342 1BTN I3P 0.0004185 0.54621 6.60377
343 1NYT NAP 0.0003064 0.42036 6.64207
344 3EW2 BTN 0.0005255 0.46741 6.66667
345 2O66 FLC 0.001918 0.45521 6.66667
346 1SC3 MLI 0.0005559 0.50366 6.74157
347 3K5X P8D 0.001282 0.44549 6.74157
348 4Q3F TLA 0.03617 0.40175 6.83761
349 3ZF8 GDP 0.001045 0.44915 6.88525
350 3LST SAH 0.007004 0.40674 6.89655
351 3GM5 CIT 0.02029 0.41366 6.91824
352 9LDB OXM 0.001895 0.49509 6.92771
353 9LDT OXM 0.00968 0.45633 6.92771
354 1C3V PDC 0.002662 0.44877 6.93878
355 1TUV VK3 0.0299 0.42247 7.01754
356 3BK2 U5P 0.001379 0.43906 7.02247
357 1Y42 TYR 0.003503 0.4377 7.02247
358 1O0S NAI 0.0005794 0.41881 7.02247
359 2RL1 UD1 0.001062 0.40358 7.02247
360 1QD0 RR6 0.004938 0.41687 7.03125
361 3BY8 MLT 0.003391 0.45683 7.04225
362 4NPT 017 0.00458 0.42268 7.07071
363 1SQ5 PAU 0.000682 0.46883 7.14286
364 1SQ5 ADP 0.001003 0.44461 7.14286
365 3BRE C2E 0.0001927 0.50841 7.30337
366 3DG6 MUC 0.0009056 0.44136 7.30337
367 1Z42 HBA 0.01945 0.44958 7.39645
368 1Z44 FMN 0.0009478 0.44059 7.39645
369 1Z48 FMN 0.0009729 0.43543 7.39645
370 1Z41 FMN 0.001216 0.43176 7.39645
371 1Z44 NPO 0.04436 0.42716 7.39645
372 1Z42 FMN 0.003073 0.42513 7.39645
373 4JLV ADP 0.03119 0.43207 7.43494
374 2WK1 SAH 0.0003071 0.43587 7.44681
375 3SQG COM 0.001265 0.50468 7.52688
376 3QP6 HL6 0.0004282 0.45402 7.54717
377 2BES RES 0.01083 0.40318 7.55814
378 2NCD ADP 0.00211 0.45333 7.58427
379 1RYI GOA 0.01082 0.45982 7.59162
380 1JN2 SFP 0.01076 0.48309 7.59494
381 2PFC PLM 0.0096 0.40528 7.65027
382 3CH5 GDP 0.001996 0.43264 7.69231
383 1I1Q TRP 0.003168 0.43428 7.8125
384 2IZ1 ATR 0.0008085 0.47928 7.86517
385 3PLN U5P 0.02508 0.40008 7.86517
386 4F4S EFO 0.003061 0.44027 7.89474
387 1R6W 164 0.004312 0.41092 8.07453
388 2Y6P CTP 0.001747 0.43995 8.11966
389 4EPL JAI 0.0005123 0.44598 8.14607
390 1QPB TPP 0.0004752 0.41105 8.14607
391 2YVF NAD 0.00189 0.4092 8.14607
392 2R42 FPS 0.003934 0.40136 8.14607
393 2XI7 XI7 0.001441 0.51279 8.15217
394 3BHO B4P 0.01485 0.44613 8.17308
395 3F81 STT 0.01443 0.43921 8.19672
396 3LTW HLZ 0.002767 0.45428 8.21429
397 2PR5 FMN 0.0005105 0.43676 8.33333
398 2XDQ MGX 0.002466 0.47948 8.42697
399 3M6W SAM 0.007621 0.40153 8.42697
400 1S8F GDP 0.001442 0.43349 8.47458
401 3PMD 11A 0.004348 0.42362 8.49673
402 5D63 FUC GLA GLA 0.009057 0.43015 8.53242
403 5D63 FUC GAL GLA 0.00565 0.4236 8.53242
404 1I2L DCS 0.002083 0.41105 8.55019
405 5RHN 8BR 0.002044 0.42321 8.69565
406 3TKA CTN 0.0002704 0.5584 8.70786
407 3TKA SAM 0.000349 0.43397 8.70786
408 3KMZ EQO 0.0004303 0.41235 8.70786
409 2OAT PFM 0.006187 0.40129 8.70786
410 2JL1 NAP 0.001259 0.41131 8.7108
411 3VPQ GSH 0.01275 0.41792 8.82353
412 4EXO PYR 0.0002663 0.51973 8.90411
413 1V7R CIT 0.02715 0.43167 9.13978
414 1H8P PC 0.0005679 0.51286 9.17431
415 1ECM TSA 0.0001583 0.48952 9.17431
416 2QF7 COA 0.004432 0.4145 9.26966
417 2WCV FUC 0.000818 0.45925 9.28571
418 3RGG AIR 0.0092 0.41017 9.43396
419 3KJQ B94 0.004051 0.42032 9.47368
420 2RCN GDP 0.003777 0.42614 9.55056
421 2FR6 URI 0.0003254 0.44379 9.58904
422 2FR6 CTN 0.0005082 0.43683 9.58904
423 2Y7P SAL 0.003308 0.43879 9.63303
424 1SJW NGV 0.00518 0.4079 9.72222
425 2X2T GAL NGA 0.006339 0.45798 9.80392
426 4M37 SAH 0.001575 0.41531 9.91254
427 1YRX FMN 0.001387 0.43416 9.91736
428 1XX4 BAM 0.006616 0.45701 9.96169
429 3GX0 GDS 0.001786 0.41339 10.2326
430 4F8L GAL 0.003182 0.4931 10.3448
431 1QY1 PRZ 0.001765 0.40991 10.3448
432 2GJN FMN 0.0001381 0.43111 10.3659
433 2GJN NIS 0.0005451 0.406 10.3659
434 1HFA PIO 0.01221 0.43957 10.3806
435 4O8A 2OP 0.002816 0.47646 10.3933
436 1ZED PNP 0.04617 0.40145 10.3933
437 1H8G CHT 0.03672 0.43195 10.5263
438 1WNG SAH 0.001182 0.41967 10.566
439 2Y7G AAE 0.003286 0.4154 10.6383
440 3KYF 5GP 5GP 0.002224 0.43563 10.8225
441 2HEK GDP 0.001717 0.44026 10.9551
442 2C7G FAD 0.002031 0.40446 10.9551
443 2BZ1 TAU 0.005594 0.47907 11.7347
444 1I36 NAP 0.002127 0.40371 11.7424
445 1Z45 GAL 0.008243 0.42139 11.7978
446 2ZJF BSU 0.007024 0.41501 11.7978
447 4G4S LDZ 0.00552 0.40312 11.8056
448 1ULE GLA GAL NAG 0.002481 0.47097 12
449 1PTR PRB 0.00294 0.45983 12
450 2QLX RM4 0.00353 0.45598 12.037
451 2F2U M77 0.001548 0.44211 12.0787
452 1K6M AGS 0.002566 0.40099 12.0787
453 4WX0 HXD 0.0002612 0.45705 12.1673
454 2YLD CMO 0.008483 0.43148 12.5984
455 2ZJ5 ADP 0.004496 0.43846 12.9213
456 1SJD NPG 0.001341 0.40362 12.9213
457 1VQ2 DDN 0.005801 0.40233 12.9534
458 1TH8 ADP 0.001289 0.44539 13.7931
459 1EYE PMM 0.002769 0.42695 13.9286
460 1UOU CMU 0.002934 0.42148 14.0449
461 1JH7 UVC 0.02623 0.40362 14.2857
462 4K30 NLG 0.009145 0.41941 14.375
463 1NVV GNP 0.0007121 0.40898 14.4578
464 1NVU GTP 0.002339 0.40177 14.4578
465 2IYG FMN 0.0006992 0.45088 14.5161
466 3E81 SLB 0.003363 0.44417 14.6341
467 3RF4 FUN 0.006299 0.42652 14.6552
468 1LNX URI 0.001957 0.44878 14.8148
469 2HW1 FRU 0.001252 0.46359 15.1007
470 2HW1 ANP 0.001337 0.41404 15.1007
471 2H6T IVA VAL VAL STA ALA STA 0.0005843 0.43912 15.2941
472 2V5E SCR 0.005798 0.46853 15.8416
473 2J5S KTA 0.002839 0.40998 17.1103
474 3MD0 GDP 0.009895 0.41323 18.0282
475 1WKL ADP 0.002591 0.4114 18.2482
476 2HV8 GTP 0.0005329 0.41637 18.75
477 2O2C G6Q 0.002038 0.42326 19.6629
478 3S9K CIT 0.001981 0.50448 20.339
479 1T0S BML 0.002727 0.46891 20.9302
480 2BOI MFU 0.0006006 0.47124 23.0089
481 2FYU FDN 0.0003333 0.44341 24.1935
482 1UO5 PIH 0.002777 0.49649 29.4118
483 1UO4 PIH 0.002226 0.49126 29.4118
484 2P8O BVA 0.004017 0.40823 46.1538
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