Receptor
PDB id Resolution Class Description Source Keywords
1C4U 2.1 Å EC: 3.4.21.5 SELECTIVE NON ELECTROPHILIC THROMBIN INHIBITORS WITH CYCLOHE MOIETIES. HOMO SAPIENS COMPLEX (SERINE PROTEASE-INHIBITOR) HYDROLASE HYDROLASE-HYINHIBITOR COMPLEX
Ref.: STRUCTURE OF THROMBIN COMPLEXED WITH SELECTIVE NON-ELECTROPHILIC INHIBITORS HAVING CYCLOHEXYL MOIE P1. ACTA CRYSTALLOGR.,SECT.D V. 56 294 2000
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
IH1 2:370;
Valid;
none;
Ki = 0.043 nM
581.483 C23 H29 Br N6 O5 S c1cc(...
NA 2:550;
Part of Protein;
none;
submit data
22.99 Na [Na+]
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1C4U 2.1 Å EC: 3.4.21.5 SELECTIVE NON ELECTROPHILIC THROMBIN INHIBITORS WITH CYCLOHE MOIETIES. HOMO SAPIENS COMPLEX (SERINE PROTEASE-INHIBITOR) HYDROLASE HYDROLASE-HYINHIBITOR COMPLEX
Ref.: STRUCTURE OF THROMBIN COMPLEXED WITH SELECTIVE NON-ELECTROPHILIC INHIBITORS HAVING CYCLOHEXYL MOIE P1. ACTA CRYSTALLOGR.,SECT.D V. 56 294 2000
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 26 families.
1 1C4U Ki = 0.043 nM IH1 C23 H29 Br N6 O5 S c1cc(ccc1S....
70% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 18 families.
1 1C4V Ki = 0.016 nM IH2 C30 H36 N6 O3 [H]/N=C(C1....
2 1C4U Ki = 0.043 nM IH1 C23 H29 Br N6 O5 S c1cc(ccc1S....
50% Homology Family (101)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 15 families.
1 4BAQ Ki = 0.98 nM M4Z C24 H36 N6 O3 [H]/N=C(/c....
2 2C8Z ic50 > 1 mM C2A C7 H8 Cl N c1cc(cc(c1....
3 1C1W - BAH C17 H18 N8 O2 c1cc2c(cc1....
4 4BAH Ki = 2.01 nM MEL C22 H31 N5 O4 c1cc(ccc1C....
5 2C90 ic50 = 330 uM C1M C7 H5 Cl N4 c1cc(ccc1n....
6 3SHC Ki = 1.9 uM B01 C20 H23 Cl N4 O2 c1ccc(cc1)....
7 3SI3 Ki = 69.3 uM B03 C20 H24 N4 O2 c1ccc(cc1)....
8 4BAM Ki = 1.14 nM MM9 C24 H36 N6 O3 [H]/N=C(/c....
9 4YES Ki = 9.6 nM 45S C19 H23 Cl N4 O2 Cc1ccc([nH....
10 3DUX Ki = 100 nM 64U C21 H30 Cl N3 O2 c1cc(cc(c1....
11 1K22 Ki = 4 nM MEL C22 H31 N5 O4 c1cc(ccc1C....
12 2ZHQ Ki = 0.75 uM 27U C22 H26 N4 O2 [H]/N=C(/c....
13 3HAT - MBN ABN RNG GLY VAL ARG n/a n/a
14 2ZGX Ki = 180 nM 29U C17 H25 N5 O2 [H]/N=C(/c....
15 2ZC9 Ki = 180 nM 22U C21 H24 Cl N3 O2 c1ccc(cc1)....
16 3UTU Ki = 0.012 nM 1TS C32 H34 Cl N7 O6 S [H]/N=C(/c....
17 1G32 Ki = 780 nM R11 C25 H25 N7 [H]/N=C(/c....
18 3F68 Ki = 8.7 uM 91U C23 H32 Cl N3 O3 CC(=O)N[C@....
19 2ZFP Ki = 6.8 uM 19U C16 H22 Cl N3 O2 CC[C@H](C(....
20 1A4W Ki = 1.2 uM QWE C29 H40 N7 O4 S2 CN(C)c1ccc....
21 2ZGB Ki = 0.54 uM 21U C18 H26 Cl N3 O2 CC(C)C[C@H....
22 3SI4 Ki = 132.2 uM B04 C21 H27 N4 O2 C[n+]1cccc....
23 2C8X ic50 = 220 nM C5M C27 H33 Cl N2 O4 S Cc1cc(c(c(....
24 1C5O Ki = 320 uM BAM C7 H9 N2 c1ccc(cc1)....
25 2C8Y - C3M C20 H22 N2 O3 S c1ccc(cc1)....
26 1D4P Ka = 2000000 M^-1 BPP C22 H25 N4 O c1ccc(cc1)....
27 3SHA Ki = 2.6 uM P97 C20 H23 Cl N4 O2 c1ccc(cc1)....
28 2ZNK Ki = 0.02 uM 31U C19 H29 N5 O2 [H]/N=C(/c....
29 3QX5 Ki = 63.5 uM 02P C21 H26 Cl N4 O2 C[n+]1ccc(....
30 4BAK Ki = 1.22 nM M67 C25 H38 N6 O3 [H]/N=C(/c....
31 3P17 Ki = 33.4 uM 99P C20 H24 N4 O2 c1ccc(cc1)....
32 1GHV Ki = 45 uM 120 C13 H12 N5 O c1cc2c(cc1....
33 1C1U - BAI C16 H14 N6 c1ccc2c(c1....
34 2ZI2 Ki = 5.7 uM 24U C17 H24 N4 O2 [H]/N=C(/c....
35 1QBV Ki = 4100 nM PPX C21 H27 N5 O2 c1ccc(cc1)....
36 3EGK Ki = 22 uM M18 C20 H27 Cl N2 O5 CC(C)(C)OC....
37 1D3P Ka = 24300000 M^-1 BT3 C32 H37 N3 O3 S c1cc(ccc1C....
38 1A2C Ki = 22 fM 34H LEU PRJ OAR n/a n/a
39 3QTV Ki = 22.5 uM 06P C21 H27 N4 O2 C[n+]1ccc(....
40 1AIX - T19 C32 H34 B N3 O6 B([C@H](C(....
41 2ZDA - 32U C22 H28 N5 O2 c1ccc(cc1)....
42 1K21 Ki = 4.2 nM IGN C21 H38 N6 O4 C1CCC(CC1)....
43 4BAN Ki = 2.43 nM M6S C23 H34 N6 O3 [H]/N=C(/c....
44 1G30 Ki = 140 nM T87 C29 H31 N7 O3 [H]/N=C(/c....
45 1MU6 Ki = 4.2 nM CDA C20 H19 F3 N6 O2 CC1=CN=C(C....
46 1FPC Ki = 0.1 uM 0ZI C25 H39 N6 O3 S NULL
47 2ZF0 - 51U C22 H27 N3 O2 Cc1cccc(c1....
48 1W7G Ki ~ 13 uM MIU C20 H32 F3 N7 O3 S c1cc(cc(c1....
49 3DHK Ki = 47 nM 23U C27 H28 Cl N3 O2 c1ccc(cc1)....
50 2ZDV - 37U C21 H24 F N3 O2 c1ccc(cc1)....
51 2ZO3 Ki = 0.1 nM 33U C28 H31 N5 O2 [H]/N=C(/c....
52 1NRS - LEU ASP PRO ARG n/a n/a
53 3TU7 ic50 = 0.046 uM 0BM C22 H34 N6 O4 S [H]/N=C(N)....
54 1KTS Ki = 4.5 nM C24 C27 H29 N7 O3 CCOC(=O)CC....
55 1GHY Ki = 0.008 uM 121 C13 H12 N5 O c1cc(c(nc1....
56 1MU8 Ki = 1 nM CDB C21 H23 F3 N6 O2 Cc1ccnc(c1....
57 1MUE Ki = 2.3 nM CDD C20 H17 Cl F3 N5 O3 c1ccc(c(c1....
58 2C8W ic50 = 3.5 nM C7M C25 H30 Cl N6 O4 S COc1ccc(cc....
59 1O5G Ki = 11 uM CR9 C21 H23 F N4 O2 C[C@H]1CCC....
60 1BCU Kd ~ 0.53 mM PRL C13 H11 N3 c1cc(cc2c1....
61 3QTO Ki = 74.8 uM 10P C21 H27 N4 O2 C[n+]1cccc....
62 1GHW Ki = 4 uM BMZ C14 H13 N4 O c1ccc(c(c1....
63 1C1V Ki = 0.023 uM BAB C17 H19 N8 c1cc2c(cc1....
64 1TOM Ki = 0.09 nM MIN C22 H34 N4 O2 CN[C@H](Cc....
65 1KTT ic50 = 1.5 uM C02 C22 H21 N5 O2 S Cn1c2ccc(c....
66 3SV2 Ki = 64 uM P05 C20 H24 N4 O2 c1ccc(cc1)....
67 1O2G Ki = 0.76 uM 696 C21 H17 N3 O c1ccc(cc1)....
68 2C93 ic50 = 12 uM C4M C20 H28 N2 O4 S Cc1cc(c(c(....
69 4LXB ic50 = 7 nM 7R9 C26 H32 Cl F2 N5 O6 S2 CN(C)[C@H]....
70 3QWC Ki = 55.4 uM 98P C21 H26 Cl N4 O2 C[n+]1ccc(....
71 1D3D Ka = 1240000000 M^-1 BZT C32 H35 Br N2 O2 S c1cc(ccc1c....
72 4UFG - D6J C29 H35 N5 O4 S CC[C@@H](C....
73 5AFZ Kd = 0.16 uM UET C26 H29 N5 O4 S c1ccc(cc1)....
74 4UE7 Kd = 107 uM MRZ C6 H13 N3 [H]/N=C(N)....
75 3BIU - 10U C20 H29 N5 O2 c1cc(ccc1C....
76 4UFF - 6V2 C27 H31 N5 O4 S [H]/N=C(c1....
77 5AHG - Y4L C8 H11 Cl N2 O2 S CN(C)S(=O)....
78 3BIV - 11U C21 H31 N5 O2 [H]/N=C(/c....
79 4AX9 Ki = 0.00027 uM N5N C26 H34 N6 O6 S [H]/N=C(/N....
80 4UEH Kd = 355 uM BEN C7 H8 N2 [H]/N=C(c1....
81 4UFD - S49 C29 H33 N5 O4 S [H]/N=C(/c....
82 2V3O - I26 C24 H33 F N4 O3 [H]/N=C(/c....
83 5AF9 Kd = 1003 uM SJR C13 H12 N2 O2 COc1ccc(cc....
84 4UD9 Kd = 475 uM FQI C5 H4 Cl N O S c1cc(sc1C(....
85 1T4U - 81A C20 H25 N3 O7 S2 [H]/N=C(N)....
86 2R2M Ki = 47.1 nM I50 C19 H21 Cl F3 N5 O2 [H]/N=C(/N....
87 5AFY - WCE C7 H6 Cl N O c1cc(cc(c1....
88 1T4V ic50 = 0.021 uM 14A C19 H27 Cl N4 O3 C=CCN(C1CC....
89 4UFE - 3ZD C27 H31 N5 O4 S [H]/N=C(c1....
90 4UDW Kd = 0.27 uM N6L C21 H23 Cl2 N3 O2 c1ccc(cc1)....
91 2CF8 Ki = 0.008 uM ESH C26 H31 Cl N4 O [H]/N=C(c1....
92 2CF9 Ki = 0.015 uM 348 C27 H34 N4 O2 [H]/N=C(c1....
93 1VZQ Ki = 36 nM SHY C24 H24 N4 O5 [H]/N=C(c1....
94 2HGT - DPN PRO ARG n/a n/a
95 3VXE - DPN PRO ARG n/a n/a
96 1C4V Ki = 0.016 nM IH2 C30 H36 N6 O3 [H]/N=C(C1....
97 2V3H - I25 C24 H34 N4 O3 [H]/N=C(/c....
98 2CN0 Ki = 22 nM F25 C24 H27 F3 N4 O c1cc(ccc1C....
99 1C4U Ki = 0.043 nM IH1 C23 H29 Br N6 O5 S c1cc(ccc1S....
100 1OYT Ki = 0.057 uM FSN C23 H24 F N4 O2 c1cc(ccc1C....
101 1TMT - DPN PRO ARG n/a n/a
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: IH1; Similar ligands found: 3
No: Ligand ECFP6 Tc MDL keys Tc
1 IH1 1 1
2 00P 0.652632 0.882353
3 00R 0.408333 0.833333
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1C4U; Ligand: IH1; Similar sites found: 274
This union binding pocket(no: 1) in the query (biounit: 1c4u.bio1) has 19 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1Y1A GSH 0.002969 0.48315 None
2 1UO5 PIH 0.003031 0.47753 None
3 1UO4 PIH 0.003268 0.46544 None
4 4TMK T5A 0.01267 0.42862 None
5 1UW1 ADP 0.003541 0.42653 None
6 2XRH NIO 0.007468 0.4243 None
7 1Q3P GLU ALA GLN THR ARG LEU 0.003197 0.41739 None
8 2OHV NHL 0.001915 0.42633 0.772201
9 3SHR CMP 0.003617 0.41031 0.772201
10 1GVF PGH 0.009999 0.40211 1.1583
11 1G8S MET 0.003661 0.432 1.30435
12 1ULE GLA GAL NAG 0.008258 0.42888 1.33333
13 2EB5 OXL 0.003919 0.43068 1.5444
14 5EQU AKG 0.02435 0.40618 1.5444
15 4BT5 23B 0.00676 0.4043 1.55642
16 1AX2 NDG GAL 0.0006718 0.45084 1.67364
17 3RF4 FUN 0.003062 0.42349 1.72414
18 1Y7P RIP 0.00487 0.42648 1.79372
19 2Q8H TF4 0.0001147 0.52916 1.9305
20 5D63 FUC GLA GLA 0.0009064 0.45898 1.9305
21 2ZE3 AKG 0.003185 0.42851 1.9305
22 2AEB ABH 0.001571 0.42055 1.9305
23 1NNS ASP 0.005702 0.4026 1.9305
24 1B5E DCM 0.004015 0.4134 2.03252
25 1PR9 NAP 0.001767 0.41808 2.04918
26 4AF5 CIT 0.0007978 0.46145 2.10526
27 4W6Z ETF 0.001296 0.47648 2.3166
28 1ZFJ IMP 0.0007332 0.47528 2.3166
29 3MAG 3MA 0.003549 0.46357 2.3166
30 3FW3 GLC 0.03567 0.44265 2.3166
31 4M5P MLA 0.01553 0.4299 2.3166
32 2JFV FLC 0.00633 0.4214 2.3166
33 9LDT OXM 0.02476 0.4192 2.3166
34 3I51 45C 0.002072 0.41483 2.3166
35 9LDB OXM 0.03184 0.41341 2.3166
36 1LDM OXM 0.005643 0.40278 2.3166
37 3NKS ACJ 0.002787 0.40125 2.3166
38 1QDS PGA 0.0007109 0.43781 2.39044
39 1YFZ IMP 0.009684 0.40773 2.43902
40 5A2J ALA PRO ASP THR ARG PRO 0.02989 0.40484 2.45902
41 2FMD MAN MAN 0.001153 0.40531 2.5
42 4DN8 BMA 0.01455 0.40525 2.5641
43 4B16 NAG 0.0032 0.46592 2.7027
44 1I0Z OXM 0.00821 0.4363 2.7027
45 4LO6 SIA GAL 0.005631 0.43335 2.7027
46 3RKR NAP 0.001821 0.42191 2.7027
47 1XX4 BAM 0.008439 0.40769 2.7027
48 3A8U PLP 0.001797 0.40615 2.7027
49 4KCT FDP 0.003774 0.40499 2.7027
50 4EXO PYR 0.01715 0.41356 2.73973
51 2DTJ THR 0.001599 0.42412 2.80899
52 4N7C AEF 0.02337 0.40128 2.84091
53 2WCV FUC 0.004754 0.41045 2.85714
54 3W8S GSH 0.004723 0.42115 2.91262
55 1QB7 ADE 0.006249 0.40105 2.9661
56 2Y6P CTP 0.001536 0.4248 2.99145
57 3CBG FER 0.003499 0.45488 3.01724
58 3CBG 4FE 0.01385 0.43253 3.01724
59 3CEV ARG 0.000795 0.44167 3.0888
60 2C5S AMP 0.002163 0.4242 3.0888
61 3ICV NAG 0.02857 0.42141 3.0888
62 4RJK PYR 0.02711 0.40391 3.0888
63 4JEJ 1GP 0.001702 0.41806 3.27869
64 1NXJ GLV 0.005347 0.4084 3.27869
65 2Q37 3AL 0.003628 0.42608 3.31492
66 1Y13 BIO 0.004979 0.4049 3.31492
67 4Q3F TLA 0.006543 0.42076 3.4188
68 2BQP GLC 0.04318 0.41688 3.4188
69 1QH9 LAC 0.00323 0.43442 3.44828
70 4OB6 S2T 0.0006665 0.42336 3.4749
71 2HW1 FRU 0.005975 0.41676 3.4749
72 4JWX 1N4 0.007096 0.40832 3.4749
73 3BRE C2E 0.01313 0.40724 3.4749
74 1KYQ NAD 0.001319 0.40434 3.4749
75 1A5Z OXM 0.03007 0.40171 3.4749
76 1B74 DGN 0.008039 0.42944 3.54331
77 4K30 NLG 0.002347 0.42829 3.75
78 3F81 STT 0.005206 0.44623 3.82514
79 2XYA 7L4 0.02236 0.42074 3.84615
80 1RZM E4P 0.001774 0.45316 3.861
81 2R00 OEG 0.002962 0.44288 3.861
82 2VQ5 LDP 0.02031 0.41649 3.9801
83 2QGI UDP 0.00614 0.41625 4.03226
84 3B9Z CO2 0.002248 0.44143 4.2471
85 3FPZ AHZ 0.004082 0.43728 4.2471
86 2NVK NAP 0.002172 0.42968 4.2471
87 1ZED PNP 0.006444 0.42727 4.2471
88 1I36 NAP 0.0004212 0.4045 4.2471
89 1HQL GLA MBG 0.00139 0.45806 4.28016
90 1YOA FMN 0.0008236 0.50861 4.40252
91 4BAS GNP 0.001785 0.40092 4.52261
92 3UWB BB2 0.005396 0.42449 4.54545
93 3IHB TRS 0.00006755 0.61517 4.6332
94 1T3D CYS 0.002763 0.44427 4.6332
95 4G1V FAD 0.005415 0.43891 4.6332
96 1JA9 NDP 0.007624 0.42175 4.6332
97 3SUC ATP 0.002354 0.4195 4.6332
98 2DKH FAD 0.001774 0.41802 4.6332
99 2DKH 3HB 0.004023 0.41201 4.6332
100 3IHB GLU 0.0176 0.40702 4.6332
101 1UJ5 5RP 0.0006245 0.43449 4.84582
102 3VPQ GSH 0.009741 0.40762 4.90196
103 4HZO COA 0.0009466 0.44466 5.01931
104 2Z9V PXM 0.001592 0.43528 5.01931
105 4BI7 PGA 0.0007462 0.44277 5.05837
106 1V7R CIT 0.01103 0.43773 5.37634
107 3UBW 6SP 0.000402 0.52394 5.40541
108 1RYD GLC 0.002121 0.44256 5.40541
109 2Q3M MLA 0.006933 0.43999 5.40541
110 4AMV F6R 0.0007882 0.42077 5.40541
111 1MOQ GLP 0.001324 0.40429 5.40541
112 3NOJ PYR 0.00488 0.41776 5.46218
113 3UEC ALA ARG TPO LYS 0.00965 0.41914 5.47945
114 3CH5 GDP 0.001265 0.42292 5.55556
115 4NAO AKG 0.01538 0.40974 5.55556
116 1EYE PMM 0.00468 0.40146 5.55556
117 2OFE NAG 0.01658 0.40271 5.6338
118 3I7S PYR 0.006349 0.43438 5.79151
119 1NML CIT 0.004546 0.41636 5.79151
120 1V5F FAD 0.04971 0.41127 5.79151
121 1V5F TPP 0.04971 0.41127 5.79151
122 3P7I P7I 0.00639 0.41021 5.79151
123 4A6F SEP 0.003308 0.46517 5.83333
124 1SS4 GSH 0.001857 0.49769 5.88235
125 1SS4 CIT 0.04299 0.40077 5.88235
126 1XE7 GUN 0.01776 0.41943 5.91133
127 2O66 FLC 0.0002638 0.47496 5.92593
128 3S9K CIT 0.0006868 0.5117 5.9322
129 2PYU IMP 0.001731 0.43988 5.93607
130 1JAC AMG 0.004376 0.4588 6.01504
131 1LYX PGA 0.003872 0.40025 6.04839
132 2IZ1 ATR 0.001314 0.45181 6.17761
133 4USQ FAD 0.002797 0.41216 6.17761
134 3QDW A2G 0.002879 0.45912 6.29371
135 3QDY A2G GAL 0.009266 0.42647 6.29371
136 3QDT A2G GAL 0.01045 0.42394 6.29371
137 3QDV A2G 0.01584 0.42194 6.29371
138 3QDW NDG 0.02451 0.40032 6.29371
139 3QDV NDG 0.02457 0.40026 6.29371
140 1H8P PC 0.0112 0.42953 6.42202
141 2X2T GAL NGA 0.01397 0.42469 6.53595
142 2FWP ICR 0.002337 0.41618 6.55738
143 2FWP CIT 0.004458 0.40117 6.55738
144 2BLE 5GP 0.003858 0.42813 6.56371
145 3FN0 TRP ASN TRP PHE ASP ILE THR ASN LYS 0.000008221 0.54979 6.92641
146 5DTF 5CT 0.003119 0.4532 6.95652
147 1Y0L HAN 0.001863 0.47823 7.07965
148 5D6C 57S 0.003649 0.45832 7.14286
149 3OAZ 2M5 0.0001556 0.54126 7.17489
150 5DS8 GLY 5CT GLY ALA 0.001766 0.46109 7.20721
151 5DUB GLY 5GG GLY ALA 0.003923 0.44831 7.20721
152 3I8T LBT 0.003408 0.42156 7.31707
153 1WRA PC 0.01781 0.40678 7.72201
154 1QD0 RR6 0.03608 0.41052 7.8125
155 1WHT BZS 0.004697 0.42718 7.84314
156 1C1L GAL BGC 0.003118 0.44185 8.0292
157 1NME 159 0.0005829 0.49385 8.21918
158 2XI7 XI7 0.005847 0.46184 8.33333
159 1O9U ADZ 0.003254 0.45646 8.33333
160 1Z42 HBA 0.007961 0.45639 8.33333
161 4B9E FAH 0.001958 0.45118 8.33333
162 1YBH P22 0.0004316 0.44624 8.33333
163 1WTC ACP 0.002768 0.44423 8.33333
164 1RYI GOA 0.02046 0.43567 8.33333
165 1Z44 NPO 0.02271 0.42929 8.33333
166 1OFH ADP 0.004977 0.42311 8.33333
167 1FW1 GSH 0.000994 0.42189 8.33333
168 3GTD MLI 0.004846 0.42067 8.33333
169 3ZPG 5GP 0.02423 0.41261 8.49421
170 3GD8 BOG 0.008126 0.42922 8.52018
171 4WBD ADP 0.01622 0.40867 8.88031
172 4F8L GAL 0.003753 0.47243 8.96552
173 4JCA CIT 0.0163 0.42879 8.98204
174 4GO7 THR 0.001857 0.42159 9
175 3V0W PA1 GLC GLC GLC GM0 GLA GM0 GMH KDO KDO 0.009777 0.44486 9.13242
176 3U1T MLI 0.002011 0.45064 9.26641
177 1NU4 MLA 0.03653 0.41023 9.27835
178 3R51 MMA 0.01236 0.42737 9.375
179 2Q1A 2KT 0.005512 0.42408 9.65251
180 2BOI MFU 0.0003581 0.46217 9.73451
181 1PTR PRB 0.0006884 0.47214 10
182 1Y75 NAG 0.006178 0.40587 10.1695
183 3PNA CMP 0.001212 0.43431 10.3896
184 1OGD RIP 0.001746 0.43363 10.687
185 2BZ1 TAU 0.004059 0.47056 11.1111
186 2Y7P SAL 0.00445 0.41674 11.1111
187 1CKN GTP 0.004034 0.41333 11.1111
188 2W8Q SIN 0.01934 0.40511 11.1111
189 2HVK TBA 0.005584 0.42383 11.3208
190 1A5V Y3 0.003073 0.42917 11.3924
191 4M7J KDA KDO KDO 0.01593 0.412 11.4155
192 3PHQ KDO 0.01034 0.45345 11.5207
193 4ODV GP1 Z9M 0.0004384 0.52365 11.6279
194 1MRE GDP 0.003179 0.44505 11.6279
195 2BMK PDD 0.001779 0.44945 11.7371
196 1LNX URI 0.003187 0.42277 12.3457
197 5DRN 5CT 0.001148 0.48403 12.5
198 5T85 44G 0.000009407 0.56404 12.7119
199 2JBH 5GP 0.003454 0.41603 12.8889
200 1JGS SAL 0.005275 0.4643 13.0435
201 2V5E SCR 0.002207 0.47437 13.8614
202 2YD6 FLC 0.001891 0.50337 13.8889
203 1TDF FAD 0.002337 0.4276 13.8889
204 1TDF NAP 0.005827 0.4276 13.8889
205 3ZGE ASP 0.0321 0.40033 13.8889
206 3BY8 MLT 0.003106 0.44192 14.7887
207 4LFL TG6 0.003661 0.41011 14.8148
208 3T2W BTN 0.00575 0.40246 15.5738
209 2E1A MSE 0.001868 0.42676 16
210 2ZWS PLM 0.0005168 0.51973 16.6667
211 1P9B HDA 0.001661 0.44065 16.6667
212 1H16 PYR 0.009632 0.42566 16.6667
213 3SQG COM 0.02016 0.42393 16.6667
214 1ZUW DGL 0.002765 0.41992 16.6667
215 4CIB 7UZ 0.005216 0.4193 16.6667
216 3QV9 QV7 0.009354 0.40838 16.6667
217 3KYF 5GP 5GP 0.004608 0.40621 16.6667
218 1EYQ NAR 0.006373 0.40533 16.6667
219 3Q9T FAY 0.005737 0.40531 16.6667
220 3VCA PRO 0.01069 0.40335 16.6667
221 1LTH FBP 0.01622 0.40315 16.6667
222 2ZJ3 G6P 0.001629 0.40031 16.6667
223 1LTH OXM 0.006611 0.4001 16.6667
224 3MD0 GDP 0.00626 0.40564 18.5328
225 1QO0 BMD 0.000942 0.45824 18.9189
226 1PEA ACM 0.01342 0.4187 18.9189
227 1DL7 NCH 0.01282 0.44305 19.4444
228 1Q3Q ANP 0.00376 0.42711 19.4444
229 4O8A 2OP 0.01785 0.41932 19.4444
230 1T0S BML 0.02014 0.41017 19.4444
231 2QCX PF1 0.01235 0.40317 19.4444
232 3WUD GLC GAL 0.02847 0.40287 19.8529
233 1GPJ CIT 0.002169 0.44212 22.2222
234 3LTW HLZ 0.002712 0.4378 22.2222
235 1GJW GLC 0.005067 0.4321 22.2222
236 4G28 0W8 0.001521 0.43035 22.2222
237 1BTN I3P 0.009894 0.45213 24.5283
238 4FGC PQ0 0.005598 0.41798 25
239 4P9Z NMI PTR 02K ASN NH2 0.007995 0.40616 25
240 4WVH ASP HIS ASP ALA HIS ALA 0.008001 0.40135 25
241 4TSK NDP 0.0003596 0.46657 27.7778
242 1SAZ ACP 0.0009179 0.46218 27.7778
243 2XDQ MGX 0.006836 0.4403 27.7778
244 1WDA BAG 0.001035 0.43707 27.7778
245 2P69 PLP 0.00302 0.4295 27.7778
246 1T10 F6P 0.006703 0.41461 27.7778
247 3RK0 AMP 0.002195 0.41388 27.7778
248 3JQ3 ADP 0.003604 0.41037 27.7778
249 3L6R MLI 0.001789 0.45299 28.5714
250 2YIV YIV 0.0001033 0.52027 30.5556
251 2YIV NBN 0.005614 0.43004 30.5556
252 2WMO GTP 0.001918 0.41143 30.5556
253 1I1Q TRP 0.003024 0.41835 33.3333
254 1U3I GSH 0.006088 0.41641 33.3333
255 1FIQ SAL 0.002307 0.41265 33.3333
256 1FIQ MTE 0.002122 0.41125 33.3333
257 1HFA PIO 0.0004451 0.53646 35.7143
258 1KC7 PPR 0.009706 0.41902 35.7143
259 3A1I UNU 0.00269 0.41532 35.7143
260 1VR0 3SL 0.005023 0.40949 35.7143
261 4C2G ALA ALA ALA ALA 0.005748 0.40713 36.1111
262 3UDG TMP 0.01504 0.42308 38.8889
263 3DCM SAM 0.0005974 0.4107 41.6667
264 3O03 GCO 0.001347 0.47564 42.8571
265 1VBH PEP 0.00486 0.42062 42.8571
266 3CF6 SP1 0.0007986 0.42057 42.8571
267 4K7O EKZ 0.01706 0.40765 42.8571
268 2VAR AMP 0.004754 0.40568 42.8571
269 1X92 M7P 0.003093 0.40826 44.4444
270 1GJC 130 0.001411 0.43166 45.0593
271 1OSS BEN 0.000005908 0.62631 47.0852
272 2AIQ BEN 0.0001715 0.54602 48.9177
273 1IAU ACE ILE GLU PRO ASJ 0.01471 0.42009 49.3392
274 1PQ7 ARG 0.00009681 0.52709 49.5536
275 1SC3 MLI 0.0003634 0.49405 50
276 2VDJ HSE 0.02239 0.40794 50
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