Receptor
PDB id Resolution Class Description Source Keywords
1P7T 1.95 Å EC: 2.3.3.9 STRUCTURE OF ESCHERICHIA COLI MALATE SYNTHASE G:PYRUVATE:ACE COENZYME A ABORTIVE TERNARY COMPLEX AT 1.95 ANGSTROM RESOLU ESCHERICHIA COLI STR. K12 SUBSTR. TIM BARREL GLYOXYLATE CYCLE ACETYL-COA CYSTEINE-SULFENIC LYASE
Ref.: STRUCTURE OF THE ESCHERICHIA COLI MALATE SYNTHASE G:PYRUVATE:ACETYL-COENZYME A ABORTIVE TERNARY COMPL 1.95 ANGSTROM RESOLUTION PROTEIN SCI. V. 12 1822 2003
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ACO A:800;
B:900;
Valid;
Valid;
none;
none;
submit data
809.571 C23 H38 N7 O17 P3 S CC(=O...
MG A:1000;
B:1001;
Part of Protein;
Part of Protein;
none;
none;
submit data
24.305 Mg [Mg+2...
PEG A:1001;
Invalid;
none;
submit data
106.12 C4 H10 O3 C(COC...
PG4 B:1002;
B:1003;
Invalid;
Invalid;
none;
none;
submit data
194.226 C8 H18 O5 C(COC...
PYR A:810;
B:910;
Valid;
Valid;
none;
none;
Ki = 1 mM
88.062 C3 H4 O3 CC(=O...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1P7T 1.95 Å EC: 2.3.3.9 STRUCTURE OF ESCHERICHIA COLI MALATE SYNTHASE G:PYRUVATE:ACE COENZYME A ABORTIVE TERNARY COMPLEX AT 1.95 ANGSTROM RESOLU ESCHERICHIA COLI STR. K12 SUBSTR. TIM BARREL GLYOXYLATE CYCLE ACETYL-COA CYSTEINE-SULFENIC LYASE
Ref.: STRUCTURE OF THE ESCHERICHIA COLI MALATE SYNTHASE G:PYRUVATE:ACETYL-COENZYME A ABORTIVE TERNARY COMPL 1.95 ANGSTROM RESOLUTION PROTEIN SCI. V. 12 1822 2003
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 5 families.
1 1P7T Ki = 1 mM PYR C3 H4 O3 CC(=O)C(=O....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 5 families.
1 1P7T Ki = 1 mM PYR C3 H4 O3 CC(=O)C(=O....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 4 families.
1 1P7T Ki = 1 mM PYR C3 H4 O3 CC(=O)C(=O....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: ACO; Similar ligands found: 170
No: Ligand ECFP6 Tc MDL keys Tc
1 ACO 1 1
2 3KK 0.9 0.988636
3 COS 0.898305 0.944444
4 CAO 0.898305 0.934066
5 2MC 0.893443 0.945652
6 OXK 0.892562 0.966292
7 MC4 0.887097 0.935484
8 1VU 0.885246 0.977528
9 CO6 0.885246 0.988636
10 CAA 0.879032 0.977273
11 SOP 0.877049 0.966292
12 IVC 0.870968 0.977273
13 1HE 0.870968 0.966667
14 MLC 0.870968 0.966292
15 BCO 0.870968 0.966292
16 3HC 0.870968 0.977273
17 FYN 0.868852 0.965909
18 COO 0.864 0.966292
19 MCA 0.864 0.977528
20 COK 0.861789 0.944444
21 0T1 0.857143 0.94382
22 SCA 0.857143 0.966292
23 COA 0.857143 0.965909
24 DCA 0.855932 0.94382
25 CMC 0.854839 0.944444
26 30N 0.85124 0.885417
27 HGG 0.850394 0.966292
28 IRC 0.850394 0.977273
29 BYC 0.850394 0.966292
30 COW 0.850394 0.955556
31 1GZ 0.850394 0.955556
32 BCA 0.84375 0.955556
33 FAQ 0.84375 0.966292
34 2CP 0.84252 0.955556
35 A1S 0.84127 0.966292
36 ETB 0.840336 0.932584
37 GRA 0.837209 0.966292
38 HXC 0.837209 0.988764
39 AMX 0.836066 0.954545
40 TGC 0.830769 0.955556
41 SCO 0.829268 0.94382
42 CMX 0.829268 0.94382
43 1CZ 0.824427 0.955556
44 CO8 0.824427 0.988764
45 2NE 0.824427 0.945055
46 FAM 0.822581 0.923077
47 FCX 0.822581 0.913043
48 2KQ 0.821705 0.988764
49 COF 0.821705 0.923913
50 3CP 0.821705 0.944444
51 UCC 0.818182 0.988764
52 ST9 0.818182 0.988764
53 DCC 0.818182 0.988764
54 MFK 0.818182 0.988764
55 5F9 0.818182 0.988764
56 MYA 0.818182 0.988764
57 HAX 0.816 0.923077
58 4CA 0.815385 0.934066
59 WCA 0.80597 0.945055
60 CS8 0.80597 0.977778
61 SCD 0.804688 0.94382
62 CA6 0.80315 0.896907
63 MCD 0.80315 0.966292
64 4KX 0.8 0.934783
65 HDC 0.8 0.988764
66 CIC 0.796992 0.944444
67 NMX 0.796875 0.875
68 MRS 0.794118 0.988764
69 MRR 0.794118 0.988764
70 4CO 0.791045 0.934066
71 0FQ 0.791045 0.944444
72 CAJ 0.790698 0.944444
73 YNC 0.788321 0.955556
74 DAK 0.788321 0.934783
75 01A 0.785185 0.904255
76 0ET 0.785185 0.966667
77 8Z2 0.782609 0.977778
78 HFQ 0.781022 0.923913
79 1CV 0.779412 0.966292
80 YE1 0.778626 0.933333
81 NHM 0.773723 0.966667
82 NHW 0.773723 0.966667
83 UOQ 0.773723 0.966667
84 CA8 0.766917 0.877551
85 1HA 0.760563 0.945055
86 NHQ 0.746479 0.955056
87 S0N 0.744526 0.923077
88 CCQ 0.744526 0.945652
89 01K 0.743056 0.966292
90 COT 0.737931 0.944444
91 CA3 0.727891 0.944444
92 UCA 0.721854 0.988764
93 CO7 0.713235 0.966292
94 CA5 0.703947 0.904255
95 93P 0.699346 0.934066
96 COD 0.692913 0.954545
97 93M 0.666667 0.934066
98 4BN 0.656627 0.946237
99 5TW 0.656627 0.946237
100 OXT 0.634731 0.946237
101 HMG 0.62585 0.933333
102 PLM COA 0.61745 0.955556
103 COA MYR 0.61745 0.955556
104 COA PLM 0.61745 0.955556
105 JBT 0.609195 0.926316
106 BSJ 0.594118 0.913979
107 PAP 0.577586 0.784091
108 PPS 0.53719 0.729167
109 191 0.532895 0.877551
110 RFC 0.53125 0.966667
111 SFC 0.53125 0.966667
112 A3P 0.525862 0.772727
113 ACE SER ASP ALY THR NH2 COA 0.505435 0.923077
114 0WD 0.503497 0.763441
115 PTJ 0.462687 0.842697
116 3AM 0.461538 0.761364
117 3OD 0.451852 0.797753
118 A22 0.450382 0.786517
119 PUA 0.447368 0.793478
120 A2D 0.446281 0.775281
121 PAJ 0.443609 0.853933
122 ATR 0.440945 0.772727
123 AGS 0.440945 0.8
124 SAP 0.440945 0.8
125 OAD 0.437037 0.797753
126 ADP 0.435484 0.795455
127 A2R 0.431818 0.786517
128 BA3 0.427419 0.775281
129 NA7 0.426471 0.829545
130 ATP 0.425197 0.795455
131 AP5 0.424 0.775281
132 B4P 0.424 0.775281
133 ADQ 0.422222 0.777778
134 5FA 0.421875 0.795455
135 AR6 0.421875 0.775281
136 APR 0.421875 0.775281
137 AQP 0.421875 0.795455
138 2A5 0.421875 0.818182
139 48N 0.42069 0.802198
140 AN2 0.420635 0.786517
141 FYA 0.42029 0.786517
142 M33 0.417323 0.786517
143 SRP 0.413534 0.808989
144 ANP 0.412214 0.777778
145 YLB 0.412162 0.877778
146 FA5 0.411348 0.788889
147 YLP 0.410959 0.877778
148 ME8 0.410072 0.835165
149 APU 0.409396 0.76087
150 5AL 0.409091 0.786517
151 7D3 0.408 0.766667
152 NJP 0.407895 0.78022
153 AD9 0.407692 0.777778
154 25L 0.407143 0.786517
155 7D4 0.40625 0.766667
156 CA0 0.40625 0.777778
157 ATF 0.406015 0.769231
158 A A A 0.405797 0.786517
159 A2P 0.404762 0.761364
160 8QN 0.404412 0.786517
161 LAQ 0.40411 0.815217
162 NDP 0.403974 0.763441
163 ACP 0.403101 0.797753
164 ACQ 0.401515 0.797753
165 YAP 0.401408 0.78022
166 ATP A A A 0.401408 0.744444
167 1ZZ 0.4 0.855556
168 PAX 0.4 0.768421
169 TXA 0.4 0.788889
170 NB8 0.4 0.782609
Ligand no: 2; Ligand: PYR; Similar ligands found: 6
No: Ligand ECFP6 Tc MDL keys Tc
1 PYR 1 1
2 ACY 0.636364 0.636364
3 OXD 0.545455 0.642857
4 KIV 0.411765 0.785714
5 AAE 0.411765 0.625
6 2KT 0.411765 0.733333
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1P7T; Ligand: PYR; Similar sites found: 215
This union binding pocket(no: 1) in the query (biounit: 1p7t.bio2) has 9 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4DG8 AMP 0.02 0.40264 0.967742
2 4IP7 FLC 0.001141 0.42285 1.28913
3 4DP3 MMV 0.02644 0.42673 1.31579
4 1EU1 MGD 0.04971 0.41029 1.36799
5 4AF0 IMP 0.003296 0.43504 1.43885
6 2Q1S NAI 0.03324 0.41161 1.59151
7 2VVL FAD 0.04791 0.42039 1.61616
8 4P53 NAI 0.007669 0.42093 1.66667
9 3ICT ADP 0.02578 0.40105 1.70068
10 4YWV SSN 0.01794 0.41697 1.72043
11 4CFP NAG AMU NAG AMV 0.02522 0.41047 1.75953
12 3UXL CFI 0.03206 0.40898 1.82768
13 2G50 PYR 0.0005157 0.4262 1.88679
14 5VQ4 ICS 0.01694 0.40398 1.91205
15 4PFO ADP 0.008228 0.4476 1.91518
16 2XAU ADP 0.01198 0.40236 1.91518
17 3ZSN MIV 0.008373 0.44289 1.91847
18 2ZPA ADP 0.01659 0.40034 1.93741
19 1XAJ CRB 0.01161 0.43245 1.9774
20 1XAJ NAD 0.01377 0.4283 1.9774
21 3OZV FAD 0.01901 0.42944 1.98511
22 3AWJ COA 0.01086 0.41635 1.99005
23 3NV6 CAM 0.003832 0.40033 1.99115
24 1VBH PEP 0.00001102 0.56391 2.05198
25 4R1S NAP 0.002831 0.44983 2.07715
26 3ZOK NAD 0.01347 0.42672 2.1164
27 1JWY ADP 0.00337 0.45519 2.18878
28 5I0H ADP BEF 0.005287 0.45334 2.18878
29 1D2N ANP 0.043 0.40122 2.20588
30 3G35 F13 0.008937 0.4313 2.28137
31 1ORR NAD 0.0116 0.42719 2.30548
32 2ZE7 DST 0.0009101 0.49523 2.37154
33 2ZE7 AMP 0.001062 0.49152 2.37154
34 4AVB CMP 0.01531 0.41258 2.4024
35 1JQN DCO 0.000003152 0.44391 2.46238
36 2C6Q IMP 0.009672 0.42244 2.5641
37 2C6Q NDP 0.03585 0.4122 2.5641
38 1KC7 PPR 0.00001051 0.55739 2.59918
39 2J3M ATP 0.007595 0.42663 2.62238
40 2J3M PRI 0.009877 0.41961 2.62238
41 3HBF UDP 0.01179 0.42415 2.64317
42 3HBF MYC 0.02283 0.42415 2.64317
43 3HWW AKG 0.02618 0.4052 2.69784
44 5TPR NAD 0.003205 0.47044 2.7027
45 3H4L ANP 0.01341 0.4191 2.7248
46 1F74 NAY 0.003238 0.43856 2.73038
47 1GQY ACP 0.008935 0.41399 2.73684
48 1P3D ANP 0.013 0.40914 2.73684
49 1CSI OAA 0.04383 0.41546 2.75862
50 3G5D 1N1 0.04602 0.42479 2.7972
51 2AG5 NAD 0.04152 0.40604 2.84553
52 2Q4H AMP 0.02767 0.41867 2.849
53 3DKP ADP 0.01676 0.4123 2.85714
54 2VVG ADP 0.008242 0.40019 2.85714
55 1MZC BNE 0.04129 0.42626 2.87958
56 4RGQ 1GP 0.04499 0.40037 2.98913
57 4RGQ NDP 0.0368 0.40003 2.98913
58 4ZKD GDP 0.02756 0.40467 3.00601
59 2VHJ ADP 0.04939 0.40638 3.02115
60 2WN6 NDP 0.0265 0.41067 3.02376
61 5D63 FUC GAL GLA 0.01652 0.43807 3.07167
62 1J99 AND 0.03719 0.41292 3.07167
63 5V2J UDP 0.04311 0.41431 3.11804
64 5V2J 7WV 0.04311 0.41431 3.11804
65 1WUR 8DG 0.02185 0.41079 3.18182
66 2VOH CIT 0.00317 0.43002 3.18471
67 5FOE GDP 0.04594 0.40733 3.2
68 5IXJ THR 0.02534 0.41323 3.28283
69 1C9K 5GP 0.001283 0.46713 3.33333
70 2X6T NAP 0.01258 0.4253 3.36134
71 5KZD RCJ 0.001531 0.46389 3.41297
72 2B3D FAD 0.01299 0.44034 3.43137
73 3UWV 2PG 0.02179 0.41051 3.44828
74 2ACV UDP 0.01872 0.4156 3.45572
75 4KCF AKM 0.007361 0.42115 3.52423
76 3G6K POP 0.003932 0.45335 3.57143
77 3G6K FAD 0.00433 0.45335 3.57143
78 4IDC NDP 0.04214 0.40639 3.61446
79 4IDC 1XX 0.04214 0.40639 3.61446
80 2VQO TFG 0.01306 0.40509 3.63196
81 1U3G THF 0.006982 0.42724 3.7037
82 1XNG ATP 0.03171 0.4091 3.73134
83 1FWV SGA MAG FUC 0.01247 0.40495 3.73134
84 5M67 ADE 0.01195 0.43548 3.75783
85 5M67 3D1 0.01253 0.4339 3.75783
86 5M67 NAD 0.01265 0.43265 3.75783
87 2GRU NAD 0.02725 0.41629 3.80435
88 4U31 MVP 0.03507 0.40897 3.80674
89 1I52 CTP 0.003919 0.46917 3.81356
90 1YRB GDP 0.01406 0.41429 3.81679
91 1NXJ TLA 0.01389 0.42092 3.82514
92 4KBF AMP 0.01579 0.40949 3.83562
93 1EQ2 NAP 0.01165 0.4289 3.87097
94 3GD4 NAD 0.04069 0.40406 3.91389
95 1PJS NAD 0.02273 0.41667 3.93873
96 1NJF ADP 0.03519 0.40128 4
97 4L80 OXL 0.000000008288 0.65883 4.02299
98 2VB6 ADP BEF 0.007596 0.44615 4.02685
99 2R5N RP5 0.01489 0.42986 4.10397
100 3N0S ACO 0.04694 0.42009 4.10448
101 1S3G AP5 0.01584 0.43342 4.14747
102 1V8B NAD 0.03017 0.4039 4.17537
103 2OWZ F6P 0.02472 0.40659 4.21687
104 2PL3 ADP 0.007767 0.40873 4.23729
105 4EDK GTP 0.008815 0.42377 4.25532
106 3E9I XAH 0.02028 0.41632 4.25963
107 4FBL SPD 0.001688 0.44372 4.27046
108 3FMI KAP 0.00516 0.45664 4.38247
109 2Q8Z NUP 0.006106 0.43627 4.38596
110 3HQP OXL 0.001205 0.43268 4.40882
111 3LZW NAP 0.01303 0.44222 4.51807
112 3LZW FAD 0.007645 0.44222 4.51807
113 1A8R GTP 0.01652 0.40896 4.52489
114 2X06 NAD 0.01409 0.435 4.65116
115 2X05 X05 0.02159 0.40893 4.65116
116 5KJZ PCG 0.03358 0.40166 4.66667
117 1ZFJ IMP 0.02665 0.40647 4.68432
118 1IZC PYR 0.000003525 0.52101 4.71976
119 3LRE ADP 0.004341 0.42112 4.78873
120 3SIX GDP 0.01598 0.42125 4.84848
121 4I5I NAD 0.007134 0.42881 4.87805
122 1OJ7 NZQ 0.01217 0.4419 4.90196
123 1BG2 ADP 0.006976 0.4078 4.92308
124 4WAS NAP 0.009681 0.45744 4.94506
125 1YKJ FAD 0.02773 0.42858 5.07614
126 2FAH GDP 0.03584 0.40061 5.09868
127 1JQ5 NAD 0.03387 0.4025 5.13514
128 2VWT PYR 0.00001603 0.50872 5.24345
129 3RO7 TDR 0.02997 0.42679 5.28302
130 2CDU ADP 0.03655 0.40338 5.30973
131 3WXM GTP 0.006729 0.43898 5.31915
132 4L9Z COA 0.00000005021 0.74392 5.33516
133 4L9Z OXL 0.00000004622 0.74392 5.33516
134 3CF6 SP1 0.02933 0.41245 5.38922
135 4KCT PYR 0.0003147 0.46219 5.41082
136 4B5W PYR 0.0001286 0.53317 5.47196
137 1PS6 4TP 0.02202 0.41739 5.4878
138 2V5K OXM 0.000004513 0.56456 5.60876
139 4MUV PCG 0.02809 0.40337 5.6338
140 3B7G ANP 0.01262 0.41994 5.65217
141 4IWN GEK 0.02093 0.40491 5.67686
142 1RVV INI 0.02463 0.40116 5.84416
143 3H4S ADP 0.004137 0.42616 5.92593
144 1P72 ADP 0.04636 0.40191 5.98802
145 1I36 NAP 0.03229 0.4106 6.06061
146 1DQS NAD 0.005365 0.47181 6.10687
147 1DQS CRB 0.01465 0.46873 6.10687
148 1WVC CTP 0.04014 0.40141 6.17761
149 4N82 FMN 0.0204 0.41269 6.17978
150 4MXP DB4 0.01038 0.42787 6.40244
151 3ZEU AGS 0.02285 0.40904 6.49351
152 3ZEU ADP 0.02007 0.40904 6.49351
153 2EXX NAP 0.02737 0.40696 6.53595
154 3VMF GTP 0.01741 0.40364 6.70241
155 2PID YSA 0.01462 0.40338 6.74157
156 2C94 TSF 0.02391 0.43158 6.875
157 1NE6 SP1 0.02077 0.41748 7.06714
158 4OCJ NDG 0.03457 0.40885 7.12401
159 3S5W FAD 0.03284 0.42861 7.12743
160 1EJB INJ 0.03222 0.40447 7.14286
161 3KRL KRL 0.009029 0.4295 7.16418
162 1OIV GDP 0.03064 0.41289 7.32984
163 4MP8 NAD 0.04555 0.41157 7.37463
164 3RWO GDP 0.03777 0.40407 7.56757
165 2HMT NAI 0.01683 0.42755 7.63889
166 1GXU 2HP 0.00772 0.41493 7.69231
167 1SAY PYR 0.02719 0.41592 7.75623
168 3IUY AMP 0.01297 0.41719 7.89474
169 4LX0 BEF GDP 0.04152 0.40463 7.9096
170 1Z0A GDP 0.04118 0.40235 8.04598
171 5MEX PAP 0.005333 0.44692 8.07453
172 5MEX SZZ 0.01243 0.44692 8.07453
173 4C4P GNP 0.04068 0.40519 8.09249
174 2PZ8 APC 0.04619 0.40294 8.09859
175 1R2Q GNP 0.02897 0.42729 8.23529
176 4M3P HCS 0.01728 0.42532 8.37438
177 2GWH A3P 0.01309 0.42164 8.72483
178 3UYK 0CX 0.02095 0.43691 8.78553
179 4NG2 OHN 0.01368 0.41263 8.84956
180 2F59 INI 0.01607 0.41701 8.9172
181 2XZ9 PYR 0.00001513 0.55587 8.95062
182 2GJ3 FAD 0.005034 0.42528 9.16667
183 2Y65 ADP 0.007256 0.41085 9.31507
184 5LTJ ADP 0.01394 0.40987 9.38375
185 5O4J 9KH 0.04249 0.40812 9.48905
186 5O4J SAH 0.04249 0.40812 9.48905
187 5O4J PJL 0.03743 0.4077 9.48905
188 3IHZ FK5 0.009247 0.43992 9.52381
189 4KXQ APR 0.006933 0.42045 10
190 4XDZ NDP 0.01205 0.4238 10.2041
191 3NOJ PYR 0.007913 0.42013 10.5042
192 1ZDU P3A 0.01792 0.42371 10.6122
193 3G4Q MCH 0.01449 0.40464 10.9589
194 2BZG SAH 0.01899 0.40577 11.2069
195 5L2J 6UL 0.02499 0.42148 11.2245
196 5L2J 70E 0.02604 0.42148 11.2245
197 1F9V ADP 0.002767 0.4264 11.2392
198 2RGX AP5 0.03967 0.40848 11.6505
199 1RRM APR 0.01769 0.41639 12.1762
200 5BR4 NAD 0.04468 0.40848 12.2762
201 4W93 3L9 0.006274 0.45688 12.9032
202 1W7F ICT 0.008722 0.41132 13.0293
203 1H7F C5P 0.01016 0.43503 13.4694
204 3WG6 NDP 0.003166 0.47282 14.3322
205 5E5U MLI 0.01431 0.40049 14.3939
206 3CPJ GDP 0.02509 0.40343 14.4124
207 2XVM SAH 0.03087 0.40464 14.5729
208 1MJH ATP 0.03325 0.40546 15.4321
209 1X1Z BMP 0.006299 0.46866 15.4762
210 2KIN ADP 0.004764 0.42161 16.8067
211 1KO8 6PG 0.02142 0.40208 17.7143
212 1B7T ADP 0.01257 0.41591 24.359
213 1KK8 BEF ADP 0.005138 0.45001 24.6753
214 2HV8 GTP 0.03866 0.40495 28.125
215 2D7C GTP 0.03237 0.41219 28.5714
Pocket No.: 2; Query (leader) PDB : 1P7T; Ligand: ACO; Similar sites found: 8
This union binding pocket(no: 2) in the query (biounit: 1p7t.bio2) has 24 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 5LFV SIA GAL NAG 0.01625 0.41153 2.83912
2 4L80 1VU 0.000003558 0.53151 4.02299
3 4L9Z COA 0.00000001461 0.65054 5.33516
4 4L9Z OXL 0.00000001848 0.64389 5.33516
5 1INN MET 0.03265 0.40204 5.42169
6 5V4R MGT 0.02227 0.41755 5.55556
7 1GEG GLC 0.01016 0.41948 7.03125
8 1HSR BHO 0.01236 0.43009 9.59302
Pocket No.: 3; Query (leader) PDB : 1P7T; Ligand: ACO; Similar sites found: 9
This union binding pocket(no: 3) in the query (biounit: 1p7t.bio1) has 25 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4WOE ADP 0.01335 0.42409 1.53631
2 5KJW 53C 0.02051 0.41109 2.57611
3 4YVN EBS 0.02659 0.4067 2.72904
4 1DQN IMU 0.02449 0.40329 3.47826
5 1YQC GLV 0.00103 0.47657 4.11765
6 4A91 GLU 0.004867 0.44945 5.03356
7 1Z6K OAA 0.01672 0.41648 5.46075
8 3ALT MLB 0.04445 0.40649 7.00637
9 2BO9 VAL 0.03101 0.40205 10.0649
Pocket No.: 4; Query (leader) PDB : 1P7T; Ligand: PYR; Similar sites found: 30
This union binding pocket(no: 4) in the query (biounit: 1p7t.bio1) has 9 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2VVM FAD 0.04213 0.42479 1.61616
2 3EBL GA4 0.01837 0.4017 2.19178
3 1DLJ UGA 0.01668 0.41427 2.23881
4 1YB5 NAP 0.007161 0.44317 2.2792
5 5FJN BE2 0.0447 0.41951 2.41228
6 5FJN FAD 0.04871 0.4146 2.41228
7 4R0M FA5 0.03994 0.4099 2.48834
8 1WP4 NDP 0.04037 0.41401 2.76817
9 4HIA FMN 0.03014 0.40339 2.84091
10 1IXE COA 0.008158 0.4101 2.91777
11 5MSO NAP 0.02532 0.40195 3.14637
12 1DJN ADP 0.02963 0.41496 3.29218
13 1QZR CDX 0.02329 0.42146 3.34928
14 2Q46 NAP 0.03202 0.40189 3.55731
15 1D6H COA 0.03372 0.41228 3.61757
16 2J5V PCA 0.003773 0.40832 3.81471
17 1NJF AGS 0.03806 0.40387 4
18 1VP5 NAP 0.04154 0.40265 4.02685
19 3MTW M3R 0.0228 0.40003 4.4665
20 2HSA FMN 0.01419 0.42782 4.47761
21 5A65 TPP 0.01929 0.41107 4.60829
22 3A23 GAL 0.01058 0.40452 4.72313
23 2ZIF SAM 0.01046 0.42606 5.05051
24 4PVD NDP 0.03951 0.4013 5.55556
25 1ZGA HMK 0.01422 0.40234 5.88235
26 3H22 B53 0.01308 0.41249 8.75421
27 1JIL 485 0.03361 0.4022 8.80952
28 1VLJ NAP 0.02666 0.40949 9.09091
29 1OT6 HC4 0.0155 0.40826 9.6
30 3DLS ADP 0.01552 0.40313 11.0448
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