Receptor
PDB id Resolution Class Description Source Keywords
2XIQ 1.95 Å EC: 5.4.99.2 CRYSTAL STRUCTURE OF HUMAN METHYLMALONYL-COA MUTASE IN COMPLEX WITH ADENOSYLCOBALAMIN AND MALONYL-COA HOMO SAPIENS ORGANIC ACIDURIA ISOMERASE METABOLIC DISEASE VITAMIN B12
Ref.: STRUCTURES OF THE HUMAN GTPASE MMAA AND VITAMIN B12-DEPENDENT METHYLMALONYL-COA MUTASE AND INSIGHT INTO THEIR COMPLEX FORMATION. J.BIOL.CHEM. V. 285 38204 2010
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
5AD A:4001;
B:4001;
Valid;
Valid;
none;
none;
submit data
251.242 C10 H13 N5 O3 C[C@@...
B12 A:3001;
B:3001;
Part of Protein;
Part of Protein;
none;
none;
submit data
1330.36 C62 H89 Co N13 O14 P Cc1cc...
MLC A:5001;
B:5001;
Valid;
Valid;
none;
none;
submit data
853.58 C24 H38 N7 O19 P3 S CC(C)...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2XIQ 1.95 Å EC: 5.4.99.2 CRYSTAL STRUCTURE OF HUMAN METHYLMALONYL-COA MUTASE IN COMPLEX WITH ADENOSYLCOBALAMIN AND MALONYL-COA HOMO SAPIENS ORGANIC ACIDURIA ISOMERASE METABOLIC DISEASE VITAMIN B12
Ref.: STRUCTURES OF THE HUMAN GTPASE MMAA AND VITAMIN B12-DEPENDENT METHYLMALONYL-COA MUTASE AND INSIGHT INTO THEIR COMPLEX FORMATION. J.BIOL.CHEM. V. 285 38204 2010
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 2XIQ - MLC C24 H38 N7 O19 P3 S CC(C)(CO[P....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 2XIQ - MLC C24 H38 N7 O19 P3 S CC(C)(CO[P....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 2XIQ - MLC C24 H38 N7 O19 P3 S CC(C)(CO[P....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: 5AD; Similar ligands found: 196
No: Ligand ECFP6 Tc MDL keys Tc
1 5AD 1 1
2 XYA 0.672727 0.854839
3 ADN 0.672727 0.854839
4 RAB 0.672727 0.854839
5 5N5 0.649123 0.854839
6 Y3J 0.649123 0.929825
7 MTA 0.639344 0.857143
8 5CD 0.637931 0.868852
9 A4D 0.637931 0.854839
10 EP4 0.633333 0.830769
11 M2T 0.622951 0.80597
12 DTA 0.596774 0.815385
13 3DH 0.59375 0.857143
14 CC5 0.568965 0.883333
15 7D7 0.568965 0.793651
16 S4M 0.565217 0.72
17 NEC 0.558824 0.885246
18 AOC 0.558824 0.828125
19 AMP 0.552239 0.768116
20 ZAS 0.552239 0.791045
21 A 0.552239 0.768116
22 A3N 0.550725 0.815385
23 ABM 0.550725 0.771429
24 SRA 0.544118 0.726027
25 6RE 0.544118 0.757143
26 3AM 0.537313 0.753623
27 AMP MG 0.536232 0.746479
28 DSH 0.536232 0.768116
29 MAO 0.535211 0.710526
30 3AD 0.532258 0.83871
31 RP1 0.529412 0.722222
32 SP1 0.529412 0.722222
33 J7C 0.528571 0.768116
34 A2D 0.528571 0.746479
35 5AS 0.527778 0.650602
36 GJV 0.521127 0.746479
37 SON 0.520548 0.716216
38 A3G 0.514286 0.80303
39 AP2 0.513889 0.716216
40 BA3 0.513889 0.746479
41 A12 0.513889 0.716216
42 AU1 0.513514 0.726027
43 M33 0.513514 0.760563
44 MHZ 0.513514 0.710526
45 ADP 0.506849 0.746479
46 B4P 0.506849 0.746479
47 AP5 0.506849 0.746479
48 A7D 0.5 0.80303
49 AN2 0.5 0.736111
50 SAM 0.5 0.75
51 PRX 0.5 0.75
52 2AM 0.5 0.742857
53 SA8 0.493506 0.771429
54 AD9 0.493506 0.726027
55 CA0 0.493333 0.726027
56 ADP MG 0.493333 0.736111
57 ADX 0.493333 0.670886
58 CMP 0.493151 0.776119
59 A3P 0.493151 0.742857
60 2BA 0.493151 0.764706
61 ACP 0.486842 0.726027
62 BEF ADP 0.486842 0.716216
63 SFG 0.486842 0.828125
64 5X8 0.486842 0.815385
65 ATP 0.486842 0.746479
66 50T 0.486842 0.736111
67 A3T 0.486842 0.857143
68 ADP BEF 0.486842 0.716216
69 7D5 0.485294 0.684932
70 SMM 0.481481 0.72
71 ANP 0.481013 0.726027
72 AR6 0.480519 0.746479
73 5FA 0.480519 0.746479
74 AQP 0.480519 0.746479
75 APC 0.480519 0.716216
76 APR 0.480519 0.746479
77 A3S 0.48 0.815385
78 OVE 0.478873 0.712329
79 5AL 0.475 0.760563
80 EEM 0.475 0.75
81 AAT 0.475 0.746479
82 SAP 0.474359 0.706667
83 RBY 0.474359 0.716216
84 ADV 0.474359 0.716216
85 A5D 0.474359 0.815385
86 ADP PO3 0.474359 0.768116
87 AGS 0.474359 0.706667
88 QQX 0.471429 0.708333
89 5F1 0.469697 0.78125
90 A5A 0.469136 0.675
91 SAI 0.468354 0.779412
92 ATP MG 0.468354 0.736111
93 G5A 0.468354 0.630952
94 SAH 0.468354 0.791045
95 QQY 0.464789 0.71831
96 103 0.464789 0.764706
97 ACK 0.464789 0.761194
98 S7M 0.463415 0.75
99 ANP MG 0.463415 0.706667
100 GAP 0.4625 0.726027
101 TAT 0.4625 0.716216
102 ACQ 0.4625 0.726027
103 3L1 0.461538 0.772727
104 3D1 0.461538 0.772727
105 VMS 0.457831 0.658537
106 54H 0.457831 0.658537
107 52H 0.457831 0.650602
108 PAP 0.455696 0.732394
109 NVA 2AD 0.455696 0.791045
110 A2P 0.453333 0.753623
111 NOC 0.453125 0.790323
112 5I5 0.453125 0.913793
113 MAP 0.452381 0.706667
114 DAL AMP 0.452381 0.760563
115 53H 0.452381 0.650602
116 TSB 0.452381 0.666667
117 ATF 0.451219 0.716216
118 ALF ADP 0.451219 0.706667
119 ADP ALF 0.451219 0.706667
120 2VA 0.448718 0.830769
121 5SV 0.447059 0.710526
122 8QN 0.447059 0.760563
123 SSA 0.445783 0.630952
124 SRP 0.445783 0.716216
125 ADP VO4 0.445783 0.736111
126 VO4 ADP 0.445783 0.736111
127 LSS 0.44186 0.635294
128 PAJ 0.44186 0.701299
129 0UM 0.44186 0.760563
130 7D3 0.44 0.666667
131 PPS 0.439024 0.65
132 1ZZ 0.438202 0.683544
133 NVA LMS 0.436782 0.635294
134 62X 0.436782 0.72
135 A22 0.435294 0.736111
136 5CA 0.435294 0.630952
137 D3Y 0.435294 0.791045
138 KB1 0.433333 0.736111
139 MYR AMP 0.433333 0.683544
140 ARJ 0.432836 0.774194
141 VRT 0.432099 0.794118
142 SO8 0.432099 0.818182
143 OAD 0.431818 0.75
144 K15 0.431818 0.739726
145 LEU LMS 0.431818 0.635294
146 25A 0.430233 0.746479
147 GEK 0.430233 0.757143
148 S8M 0.430233 0.757143
149 OOB 0.430233 0.736111
150 WAQ 0.426966 0.697368
151 3NZ 0.426966 0.782609
152 GSU 0.426966 0.630952
153 ADZ 0.425926 0.618182
154 DSZ 0.425287 0.630952
155 ADQ 0.425287 0.726027
156 4AD 0.425287 0.706667
157 AMO 0.425287 0.716216
158 NSS 0.425287 0.630952
159 A1R 0.425287 0.697368
160 2A5 0.425 0.68
161 TXA 0.422222 0.739726
162 SXZ 0.422222 0.75
163 3OD 0.422222 0.75
164 ME8 0.422222 0.683544
165 PTJ 0.422222 0.710526
166 BIS 0.422222 0.697368
167 AHX 0.420455 0.688312
168 DLL 0.420455 0.736111
169 00A 0.420455 0.697368
170 ATR 0.419753 0.742857
171 7D4 0.417722 0.666667
172 TAD 0.416667 0.679487
173 A6D 0.41573 0.716216
174 ADP BMA 0.41573 0.726027
175 3UK 0.41573 0.726027
176 26A 0.411765 0.787879
177 AFX 0.411765 0.716418
178 P5A 0.411111 0.602273
179 LAD 0.411111 0.679487
180 PR8 0.411111 0.670886
181 A A 0.411111 0.746479
182 KAA 0.411111 0.609195
183 V3L 0.409639 0.746479
184 AMP NAD 0.409091 0.739726
185 YAP 0.408602 0.706667
186 0XU 0.407407 0.828125
187 NB8 0.406593 0.688312
188 FYA 0.406593 0.736111
189 JB6 0.406593 0.697368
190 YSA 0.404255 0.630952
191 TYR AMP 0.404255 0.716216
192 ZDA 0.402439 0.742857
193 25L 0.402174 0.736111
194 4UV 0.4 0.706667
195 A A A 0.4 0.736111
196 101 0.4 0.708333
Ligand no: 2; Ligand: MLC; Similar ligands found: 141
No: Ligand ECFP6 Tc MDL keys Tc
1 MLC 1 1
2 CAA 0.912 0.988506
3 SCA 0.889764 1
4 1VU 0.888 0.966292
5 HGG 0.882812 1
6 IVC 0.874016 0.988506
7 3HC 0.874016 0.988506
8 1HE 0.874016 0.955556
9 BCO 0.874016 0.977273
10 ACO 0.870968 0.966292
11 GRA 0.869231 1
12 OXK 0.865079 1
13 TGC 0.862595 0.988636
14 3KK 0.857143 0.977273
15 CAO 0.854839 0.944444
16 COS 0.854839 0.955056
17 2MC 0.851562 0.934783
18 FAQ 0.847328 0.977273
19 CO6 0.84375 0.977273
20 CMC 0.84375 0.977273
21 HXC 0.840909 0.955556
22 MCA 0.838462 0.988636
23 SCO 0.833333 0.977012
24 CO8 0.828358 0.955556
25 FYN 0.828125 0.977012
26 COO 0.824427 0.977273
27 MFK 0.822222 0.955556
28 ST9 0.822222 0.955556
29 UCC 0.822222 0.955556
30 5F9 0.822222 0.955556
31 MYA 0.822222 0.955556
32 DCC 0.822222 0.955556
33 SOP 0.821705 0.955056
34 COK 0.821705 0.955056
35 CMX 0.818898 0.977012
36 2CP 0.818182 0.966292
37 MC4 0.818182 0.924731
38 COA 0.816 0.977012
39 0T1 0.816 0.954545
40 1CZ 0.814815 0.988636
41 DCA 0.814516 0.932584
42 COW 0.81203 0.966292
43 3CP 0.81203 0.977273
44 1GZ 0.81203 0.966292
45 IRC 0.81203 0.988506
46 BYC 0.81203 0.977273
47 2KQ 0.81203 0.977528
48 30N 0.811024 0.894737
49 CS8 0.810219 0.945055
50 BCA 0.80597 0.966292
51 HDC 0.804348 0.955556
52 A1S 0.80303 0.955056
53 ETB 0.8 0.9
54 FCX 0.79845 0.944444
55 AMX 0.796875 0.965517
56 SCD 0.795455 0.977012
57 YNC 0.792857 0.966292
58 2NE 0.788321 0.955556
59 CIC 0.788321 0.977273
60 COF 0.785185 0.934066
61 FAM 0.784615 0.933333
62 MCD 0.780303 0.955056
63 4CA 0.779412 0.944444
64 HAX 0.778626 0.933333
65 1CV 0.771429 1
66 WCA 0.771429 0.955556
67 CAJ 0.768657 0.955056
68 CA6 0.766917 0.867347
69 4KX 0.765957 0.945055
70 NMX 0.761194 0.884211
71 MRR 0.760563 0.955556
72 MRS 0.760563 0.955556
73 0FQ 0.757143 0.955056
74 4CO 0.757143 0.944444
75 DAK 0.755245 0.945055
76 0ET 0.751773 0.934066
77 01A 0.751773 0.913979
78 8Z2 0.75 0.945055
79 CCQ 0.75 0.934783
80 CA8 0.746377 0.886598
81 YE1 0.744526 0.94382
82 NHM 0.741259 0.934066
83 NHW 0.741259 0.934066
84 UOQ 0.741259 0.934066
85 HFQ 0.736111 0.934066
86 1HA 0.72973 0.955556
87 NHQ 0.727891 0.965909
88 UCA 0.727273 0.955556
89 S0N 0.725352 0.955056
90 01K 0.713333 0.955056
91 COT 0.708609 0.955056
92 CA3 0.688312 0.955056
93 CO7 0.683099 0.977273
94 CA5 0.677215 0.913979
95 93P 0.672956 0.966292
96 93M 0.662577 0.966292
97 COD 0.661654 0.965517
98 HMG 0.633333 0.965909
99 COA PLM 0.625 0.923077
100 PLM COA 0.625 0.923077
101 COA MYR 0.625 0.923077
102 4BN 0.624277 0.914894
103 5TW 0.624277 0.914894
104 OXT 0.622093 0.914894
105 JBT 0.597765 0.915789
106 BSJ 0.573864 0.945055
107 PAP 0.54918 0.793103
108 191 0.541936 0.867347
109 SFC 0.512048 0.955556
110 RFC 0.512048 0.955556
111 PPS 0.511811 0.736842
112 A3P 0.5 0.781609
113 ACE SER ASP ALY THR NH2 COA 0.497355 0.933333
114 0WD 0.493243 0.771739
115 PTJ 0.442857 0.873563
116 3AM 0.439024 0.770115
117 A22 0.430657 0.795455
118 PUA 0.43038 0.802198
119 A2D 0.425197 0.784091
120 PAJ 0.42446 0.885057
121 3OD 0.422535 0.827586
122 SAP 0.421053 0.808989
123 ATR 0.421053 0.781609
124 AGS 0.421053 0.808989
125 ADP 0.415385 0.804598
126 48N 0.413333 0.811111
127 A2R 0.413043 0.816092
128 NA7 0.408451 0.83908
129 OAD 0.408451 0.827586
130 BA3 0.407692 0.784091
131 ATP 0.406015 0.804598
132 B4P 0.40458 0.784091
133 AP5 0.40458 0.784091
134 ADQ 0.404255 0.806818
135 AQP 0.402985 0.804598
136 AR6 0.402985 0.804598
137 5FA 0.402985 0.804598
138 2A5 0.402985 0.827586
139 APR 0.402985 0.804598
140 ME8 0.402778 0.844444
141 AN2 0.401515 0.795455
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2XIQ; Ligand: 5AD; Similar sites found: 7
This union binding pocket(no: 1) in the query (biounit: 2xiq.bio3) has 14 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 3FMI KAP 0.02283 0.40594 2.78884
2 4IGH 1EA 0.04785 0.42411 3.22581
3 4IGH ORO 0.04785 0.42411 3.22581
4 4IGH FMN 0.04785 0.42411 3.22581
5 5UGW GSH 0.008112 0.42206 4
6 5F7V GLC GLC GLC GLC 0.01352 0.41772 4.25
7 1CCW TAR 0.0001252 0.51512 45.2555
Pocket No.: 2; Query (leader) PDB : 2XIQ; Ligand: MLC; Similar sites found: 107
This union binding pocket(no: 2) in the query (biounit: 2xiq.bio3) has 31 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1DJX I3P 0.00977 0.42636 1.28205
2 5L2R MLA 0.01079 0.43451 1.3245
3 1GPM CIT 0.03294 0.40914 1.52381
4 1VJ7 GPX 0.02335 0.41258 1.78117
5 2YBP 2HG 0.02979 0.40921 1.83727
6 5F7J ADE 0.006567 0.44855 1.875
7 5FYR INS 0.02711 0.40925 2.01342
8 1RYD GLC 0.01422 0.42764 2.06718
9 1OGO BGC GLC 0.04528 0.40016 2.09059
10 2ZWI C5P 0.02679 0.40417 2.14477
11 3U6W KIV 0.01429 0.42873 2.23097
12 1OGZ EQU 0.0254 0.40173 2.4
13 3KYF 5GP 5GP 0.01852 0.41232 2.5974
14 5LX6 78P 0.03412 0.40764 2.6178
15 1OFL NGK GCD 0.03534 0.40932 2.7027
16 4YJK URA 0.008424 0.44009 2.77778
17 1I1E DM2 0.03482 0.40598 2.88714
18 3ESS 18N 0.01074 0.43232 3.04348
19 1U6R ADP 0.005953 0.42114 3.15789
20 1C1X HFA 0.01141 0.41892 3.38028
21 2OVW CBI 0.0234 0.41523 3.40633
22 5JSP DQY 0.03606 0.40324 3.48259
23 2QLU ADE 0.02795 0.40516 3.50318
24 5KJW 53C 0.003779 0.45973 3.51288
25 4XDA RIB 0.02867 0.40387 3.55987
26 5D9G GLU ASN LEU TYR PHE GLN 0.03001 0.40661 3.65854
27 5AB1 BCD TA5 HP6 MAN 0.0261 0.41507 3.66667
28 3BJE URA 0.007231 0.44592 3.72493
29 3LGS SAH 0.01213 0.41762 3.74532
30 3LGS ADE 0.0109 0.40704 3.74532
31 2VEG PMM 0.0161 0.41951 3.82166
32 3RGA LSB 0.0142 0.40704 3.88693
33 4J25 OGA 0.008843 0.44028 3.93013
34 4QAR ADE 0.01932 0.4053 3.9801
35 3ZGJ RMN 0.01427 0.42668 4.04313
36 3DG6 MUC 0.01412 0.41066 4.08719
37 1BC5 ACE ASN TRP GLU THR PHE 0.03293 0.40331 4.08922
38 4D52 GXL 0.01167 0.42958 4.12698
39 4D52 GIV 0.01195 0.42871 4.12698
40 4D4U FUC GAL 0.008589 0.42744 4.12698
41 3B6R ADP 0.002634 0.44148 4.19948
42 4RW3 IPD 0.001708 0.47125 4.30464
43 2HW1 FRU 0.04017 0.40352 4.36242
44 2HK9 SKM 0.04021 0.40636 4.36364
45 4I9A NCN 0.01194 0.4072 4.51389
46 4GLW NMN 0.03934 0.41151 4.59016
47 2FCU AKG 0.04475 0.40071 4.79233
48 3HCH RSM 0.03199 0.40275 4.79452
49 4FK7 P34 0.001199 0.47381 4.80349
50 5IFK HPA 0.00645 0.44827 4.80769
51 1EX7 5GP 0.01675 0.42298 4.85564
52 1F52 ADP 0.01865 0.40838 4.91453
53 3M3E GAL A2G NPO 0.0217 0.41006 4.96894
54 5FUI APY 0.01331 0.42054 5.30303
55 1EYE PMM 0.007521 0.42785 5.35714
56 2FKA BEF 0.004932 0.44991 5.42636
57 2ALG DAO 0.03651 0.40592 5.43478
58 2ET1 GLV 0.03584 0.4057 5.47264
59 2OMN IPH 0.01915 0.40446 5.52995
60 1QDS PGA 0.03172 0.40043 5.57769
61 2YKL NLD 0.008289 0.42577 5.66038
62 4RHS SIA SIA GAL 0.02584 0.40908 5.7377
63 5M6N 7H9 0.04678 0.40067 5.9322
64 2GOO NDG 0.01604 0.41649 6.14035
65 5V3D FCN 0.006875 0.44731 6.2069
66 3H0L ADP 0.007322 0.43722 6.38298
67 1AD4 HH2 0.007069 0.42514 6.39098
68 2VDF OCT 0.02351 0.42989 6.71937
69 5DYO FLU 0.008764 0.4391 6.88073
70 3A16 PXO 0.004395 0.43844 6.97051
71 4WOE ADP 0.001508 0.48259 7.40223
72 3THR C2F 0.009441 0.4154 7.50853
73 1DZK PRZ 0.02311 0.4003 7.64331
74 4RT1 C2E 0.01358 0.40922 8.03571
75 4FXQ G9L 0.01716 0.4231 8.04348
76 1GT4 UNA 0.004863 0.42897 8.1761
77 5H9P TD2 0.04382 0.40176 8.22785
78 1UGY GLA BGC 0.004716 0.4458 8.27068
79 1UGY GLA GLC 0.009472 0.41029 8.27068
80 3QSB 743 0.02466 0.406 8.74317
81 4BG4 ADP 0.004762 0.4256 8.98876
82 4BG4 ARG 0.04327 0.40038 8.98876
83 3NZ1 3NY 0.01852 0.42914 9.1954
84 5OFW 9TW 0.02052 0.4182 9.41704
85 2YIP YIO 0.01405 0.42907 9.42029
86 5F6U 5VK 0.0002327 0.52619 9.55414
87 2XG5 EC2 0.01927 0.40737 9.82659
88 2XG5 EC5 0.01838 0.40737 9.82659
89 3SAO DBH 0.003467 0.46265 10
90 3SAO NKN 0.009641 0.42665 10
91 2C49 ADN 0.005707 0.42198 10.2649
92 5N53 8NB 0.03431 0.40795 10.7692
93 2G30 ALA ALA PHE 0.00007107 0.56858 10.8527
94 2R5V HHH 0.009822 0.42214 10.9244
95 2JBM SRT 0.01539 0.41226 11.3712
96 3JQ3 ADP 0.004305 0.4443 11.4754
97 5EWK P34 0.02354 0.4165 11.5
98 4DSU BZI 0.003732 0.4611 11.6402
99 4RYV ZEA 0.008786 0.42998 12.2581
100 4IF4 BEF 0.02073 0.40392 12.5
101 2GVJ DGB 0.001726 0.43801 14.053
102 4BS0 6NT 0.03272 0.40346 14.1509
103 3LLZ GAL NGA 0.02447 0.41049 15.7895
104 2B7N NTM 0.01532 0.4268 17.2161
105 4H6B 10Y 0.03343 0.40297 17.4359
106 3AVR OGA 0.03804 0.40472 18.1818
107 5HZ9 5M8 0.01307 0.40665 18.5185
Pocket No.: 3; Query (leader) PDB : 2XIQ; Ligand: MLC; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 3) in the query (biounit: 2xiq.bio3) has 31 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 2XIQ; Ligand: 5AD; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 4) in the query (biounit: 2xiq.bio3) has 14 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 5; Query (leader) PDB : 2XIQ; Ligand: MLC; Similar sites found: 1
This union binding pocket(no: 5) in the query (biounit: 2xiq.bio1) has 30 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1OJJ GLC GAL 0.02272 0.41173 2.48756
Pocket No.: 6; Query (leader) PDB : 2XIQ; Ligand: 5AD; Similar sites found: 5
This union binding pocket(no: 6) in the query (biounit: 2xiq.bio1) has 14 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2ZPA ADP 0.02364 0.40178 1.34128
2 3NT6 FAD 0.0442 0.4097 2.26481
3 2OFV 242 0.03736 0.40987 5.05415
4 1LFD GNP 0.03332 0.40183 10.7784
5 5KVM THR TYR PHE ALA VAL LEU MET VAL SER 0.04807 0.4007 17.8947
Pocket No.: 7; Query (leader) PDB : 2XIQ; Ligand: 5AD; Similar sites found: 1
This union binding pocket(no: 7) in the query (biounit: 2xiq.bio2) has 14 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1DQX BMP 0.01465 0.41753 6.36704
Pocket No.: 8; Query (leader) PDB : 2XIQ; Ligand: MLC; Similar sites found: 16
This union binding pocket(no: 8) in the query (biounit: 2xiq.bio2) has 30 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4RPM HXC 0.03953 0.40302 1.47783
2 4XFM THE 0.04232 0.40105 1.50862
3 2Y5S 78H 0.01327 0.41569 2.72109
4 5MX4 HPA 0.001173 0.48905 3.43348
5 4D4U FUC GAL NAG 0.0404 0.40284 4.12698
6 1P0Z FLC 0.0144 0.4248 4.58015
7 2HZQ STR 0.03383 0.40712 4.5977
8 3KFF ZBT 0.03238 0.40768 4.93827
9 3KFF XBT 0.03238 0.40768 4.93827
10 5XLY C2E 0.01701 0.40009 5.26316
11 2IGA XXP 0.02437 0.40262 5.47945
12 3KYG 5GP 5GP 0.01858 0.40152 5.72687
13 1EPB REA 0.01988 0.40013 7.31707
14 2E27 AB0 0.0206 0.40624 12.6984
15 4H6B 10X 0.01971 0.40719 17.4359
16 5KEW 6SB 0.04608 0.40005 20.2128
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