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Related entries of code: 3u51
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1a07RCSB PDB    PDBbind107aa, >1A07:B|PDBID|CHAIN|... at 99%
1a08RCSB PDB    PDBbind107aa, >1A08:B|PDBID|CHAIN|... at 99%
1a09RCSB PDB    PDBbind107aa, >1A09:B|PDBID|CHAIN|... at 99%
1a1bRCSB PDB    PDBbind107aa, >1A1B:B|PDBID|CHAIN|... at 99%
1a1cRCSB PDB    PDBbind107aa, >1A1C:B|PDBID|CHAIN|... at 99%
1a1eRCSB PDB    PDBbind107aa, >1A1E:B|PDBID|CHAIN|... at 99%
1is0RCSB PDB    PDBbind106aa, >1IS0:B|PDBID|CHAIN|... at 97%
1nlpRCSB PDB    PDBbind64aa, >1NLP:C|PDBID|CHAIN|... at 93%
1nzlRCSB PDB    PDBbind103aa, >1NZL:B|PDBID|CHAIN|... at 97%
1nzvRCSB PDB    PDBbind103aa, >1NZV:B|PDBID|CHAIN|... at 97%
1o41RCSB PDB    PDBbind108aa, >1O41:A|PDBID|CHAIN|... at 100%
1o42RCSB PDB    PDBbind108aa, >1O42:A|PDBID|CHAIN|... at 100%
1o43RCSB PDB    PDBbind108aa, >1O43:A|PDBID|CHAIN|... at 100%
1o44RCSB PDB    PDBbind108aa, >1O44:A|PDBID|CHAIN|... at 100%
1o45RCSB PDB    PDBbind108aa, >1O45:A|PDBID|CHAIN|... at 100%
1o46RCSB PDB    PDBbind108aa, >1O46:A|PDBID|CHAIN|... at 100%
1o47RCSB PDB    PDBbind108aa, >1O47:A|PDBID|CHAIN|... at 100%
1o48RCSB PDB    PDBbind108aa, >1O48:A|PDBID|CHAIN|... at 100%
1o49RCSB PDB    PDBbind108aa, >1O49:A|PDBID|CHAIN|... at 100%
1o4aRCSB PDB    PDBbind108aa, >1O4A:A|PDBID|CHAIN|... at 100%
1o4bRCSB PDB    PDBbind108aa, >1O4B:A|PDBID|CHAIN|... at 100%
1o4dRCSB PDB    PDBbind108aa, >1O4D:A|PDBID|CHAIN|... at 100%
1o4eRCSB PDB    PDBbind108aa, >1O4E:A|PDBID|CHAIN|... at 100%
1o4fRCSB PDB    PDBbind108aa, >1O4F:A|PDBID|CHAIN|... at 100%
1o4gRCSB PDB    PDBbind108aa, >1O4G:A|PDBID|CHAIN|... at 100%
1o4hRCSB PDB    PDBbind108aa, >1O4H:A|PDBID|CHAIN|... at 100%
1o4iRCSB PDB    PDBbind108aa, >1O4I:A|PDBID|CHAIN|... at 100%
1o4jRCSB PDB    PDBbind108aa, >1O4J:A|PDBID|CHAIN|... at 100%
1o4kRCSB PDB    PDBbind108aa, >1O4K:A|PDBID|CHAIN|... at 100%
1o4lRCSB PDB    PDBbind108aa, >1O4L:A|PDBID|CHAIN|... at 100%
1o4mRCSB PDB    PDBbind108aa, >1O4M:A|PDBID|CHAIN|... at 100%
1o4nRCSB PDB    PDBbind108aa, >1O4N:A|PDBID|CHAIN|... at 100%
1o4oRCSB PDB    PDBbind108aa, >1O4O:A|PDBID|CHAIN|... at 100%
1o4pRCSB PDB    PDBbind108aa, >1O4P:A|PDBID|CHAIN|... at 100%
1o4qRCSB PDB    PDBbind108aa, >1O4Q:A|PDBID|CHAIN|... at 100%
1o4rRCSB PDB    PDBbind108aa, >1O4R:A|PDBID|CHAIN|... at 100%
1prlRCSB PDB    PDBbind64aa, >1PRL:C|PDBID|CHAIN|... at 96%
1prmRCSB PDB    PDBbind64aa, >1PRM:C|PDBID|CHAIN|... at 96%
1rlpRCSB PDB    PDBbind64aa, >1RLP:C|PDBID|CHAIN|... at 96%
1rlqRCSB PDB    PDBbind64aa, >1RLQ:C|PDBID|CHAIN|... at 96%
1shdRCSB PDB    PDBbind107aa, >1SHD:A|PDBID|CHAIN|... at 99%
1skjRCSB PDB    PDBbind113aa, >1SKJ:A|PDBID|CHAIN|... at 90%
1y57RCSB PDB    PDBbind452aa, >1Y57:A|PDBID|CHAIN|... at 99%
2bdfRCSB PDB    PDBbind279aa, >2BDF:B|PDBID|CHAIN|... at 100%
2bdjRCSB PDB    PDBbind279aa, >2BDJ:A|PDBID|CHAIN|... at 100%
2h8hRCSB PDB    PDBbind535aa, >2H8H:A|PDBID|CHAIN|... *
2hwoRCSB PDB    PDBbind286aa, >2HWO:B|PDBID|CHAIN|... at 97%
2hwpRCSB PDB    PDBbind286aa, >2HWP:B|PDBID|CHAIN|... at 97%
2oiqRCSB PDB    PDBbind286aa, >2OIQ:B|PDBID|CHAIN|... at 98%
2qq7RCSB PDB    PDBbind286aa, >2QQ7:B|PDBID|CHAIN|... at 97%
2qlqRCSB PDB    PDBbind286aa, >2QLQ:B|PDBID|CHAIN|... at 97%
3el7RCSB PDB    PDBbind286aa, >3EL7:A|PDBID|CHAIN|... at 98%
3el8RCSB PDB    PDBbind286aa, >3EL8:B|PDBID|CHAIN|... at 98%
3f3tRCSB PDB    PDBbind286aa, >3F3T:B|PDBID|CHAIN|... at 97%
3f3uRCSB PDB    PDBbind286aa, >3F3U:B|PDBID|CHAIN|... at 97%
3f3vRCSB PDB    PDBbind286aa, >3F3V:B|PDBID|CHAIN|... at 97%
3f3wRCSB PDB    PDBbind286aa, >3F3W:B|PDBID|CHAIN|... at 97%
3g5dRCSB PDB    PDBbind286aa, >3G5D:B|PDBID|CHAIN|... at 97%
3g6gRCSB PDB    PDBbind286aa, >3G6G:B|PDBID|CHAIN|... at 98%
3g6hRCSB PDB    PDBbind286aa, >3G6H:B|PDBID|CHAIN|... at 97%
3lokRCSB PDB    PDBbind286aa, >3LOK:B|PDBID|CHAIN|... at 97%
3svvRCSB PDB    PDBbind286aa, >3SVV:B|PDBID|CHAIN|... at 97%
3u4wRCSB PDB    PDBbind275aa, >3U4W:A|PDBID|CHAIN|... at 99%
3uqfRCSB PDB    PDBbind286aa, >3UQF:B|PDBID|CHAIN|... at 98%
3uqgRCSB PDB    PDBbind286aa, >3UQG:B|PDBID|CHAIN|... at 98%
4dggRCSB PDB    PDBbind286aa, >4DGG:B|PDBID|CHAIN|... at 98%
4ficRCSB PDB    PDBbind286aa, >4FIC:B|PDBID|CHAIN|... at 98%
4hxjRCSB PDB    PDBbind60aa, >4HXJ:B|PDBID|CHAIN|... at 98%
4lggRCSB PDB    PDBbind270aa, >4LGG:B|PDBID|CHAIN|... at 98%
4lghRCSB PDB    PDBbind277aa, >4LGH:B|PDBID|CHAIN|... at 98%
4mcvRCSB PDB    PDBbind278aa, >4MCV:B|PDBID|CHAIN|... at 98%
4o2pRCSB PDB    PDBbind286aa, >4O2P:B|PDBID|CHAIN|... at 98%
4ybjRCSB PDB    PDBbind286aa, >4YBJ:B|PDBID|CHAIN|... at 98%
4ybkRCSB PDB    PDBbind286aa, >4YBK:A|PDBID|CHAIN|... at 98%
4u5jRCSB PDB    PDBbind286aa, >4U5J:B|PDBID|CHAIN|... at 98%
5bmmRCSB PDB    PDBbind286aa, >5BMM:B|PDBID|CHAIN|... at 98%
5d10RCSB PDB    PDBbind286aa, >5D10:B|PDBID|CHAIN|... at 97%
5d11RCSB PDB    PDBbind286aa, >5D11:B|PDBID|CHAIN|... at 97%
5d12RCSB PDB    PDBbind286aa, >5D12:B|PDBID|CHAIN|... at 97%
6f3fRCSB PDB    PDBbind455aa, >6F3F:A|PDBID|CHAIN|... at 98%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
1a7cRCSB PDB    PDBbind6-mer
1elrRCSB PDB    PDBbind6-mer
1guiRCSB PDB    PDBbind6-mer
1gvxRCSB PDB    PDBbind6-mer
1gwmRCSB PDB    PDBbind6-mer
1k9rRCSB PDB    PDBbind6-mer
1lybRCSB PDB    PDBbind6-mer
1njtRCSB PDB    PDBbind6-mer
1okvRCSB PDB    PDBbind6-mer
1ol1RCSB PDB    PDBbind6-mer
1ol2RCSB PDB    PDBbind6-mer
1q4kRCSB PDB    PDBbind6-mer
1rhkRCSB PDB    PDBbind6-mer
1sldRCSB PDB    PDBbind6-mer
1smeRCSB PDB    PDBbind6-mer
1strRCSB PDB    PDBbind6-mer
1urcRCSB PDB    PDBbind6-mer
1xt3RCSB PDB    PDBbind6-mer
1ym2RCSB PDB    PDBbind6-mer
1zfpRCSB PDB    PDBbind6-mer
2h65RCSB PDB    PDBbind6-mer
2h6tRCSB PDB    PDBbind6-mer
2hobRCSB PDB    PDBbind6-mer
2itkRCSB PDB    PDBbind6-mer
2l65RCSB PDB    PDBbind6-mer
2oqsRCSB PDB    PDBbind6-mer
2q6fRCSB PDB    PDBbind6-mer
2qzxRCSB PDB    PDBbind6-mer
2r0zRCSB PDB    PDBbind6-mer
2w76RCSB PDB    PDBbind6-mer
2x6xRCSB PDB    PDBbind6-mer
3avzRCSB PDB    PDBbind6-mer
3aw0RCSB PDB    PDBbind6-mer
3bv9RCSB PDB    PDBbind6-mer
3driRCSB PDB    PDBbind6-mer
3eysRCSB PDB    PDBbind6-mer
3iquRCSB PDB    PDBbind6-mer
3iqvRCSB PDB    PDBbind6-mer
3fv3RCSB PDB    PDBbind6-mer
3fwvRCSB PDB    PDBbind6-mer
3h6zRCSB PDB    PDBbind6-mer
3hikRCSB PDB    PDBbind6-mer
3kd7RCSB PDB    PDBbind6-mer
3luoRCSB PDB    PDBbind6-mer
3nthRCSB PDB    PDBbind6-mer
3oldRCSB PDB    PDBbind6-mer
3pslRCSB PDB    PDBbind6-mer
3q4jRCSB PDB    PDBbind6-mer
3q4kRCSB PDB    PDBbind6-mer
3q4lRCSB PDB    PDBbind6-mer
3r5jRCSB PDB    PDBbind6-mer
3r6gRCSB PDB    PDBbind6-mer
3rjmRCSB PDB    PDBbind6-mer
3sm1RCSB PDB    PDBbind6-mer
3snaRCSB PDB    PDBbind6-mer
3snbRCSB PDB    PDBbind6-mer
3sncRCSB PDB    PDBbind6-mer
3sndRCSB PDB    PDBbind6-mer
4b4qRCSB PDB    PDBbind6-mer
3ux0RCSB PDB    PDBbind6-mer
3wqwRCSB PDB    PDBbind6-mer
3zmtRCSB PDB    PDBbind6-mer
3zmuRCSB PDB    PDBbind6-mer
3zmvRCSB PDB    PDBbind6-mer
3zmzRCSB PDB    PDBbind6-mer
3zn0RCSB PDB    PDBbind6-mer
3zn1RCSB PDB    PDBbind6-mer
4a0jRCSB PDB    PDBbind6-mer
4apoRCSB PDB    PDBbind6-mer
4b3bRCSB PDB    PDBbind6-mer
4b8yRCSB PDB    PDBbind6-mer
4c4nRCSB PDB    PDBbind6-mer
4dgbRCSB PDB    PDBbind6-mer
4er2RCSB PDB    PDBbind6-mer
4exhRCSB PDB    PDBbind6-mer
4fr3RCSB PDB    PDBbind6-mer
4fysRCSB PDB    PDBbind6-mer
4fz3RCSB PDB    PDBbind6-mer
4gyeRCSB PDB    PDBbind6-mer
4gzfRCSB PDB    PDBbind6-mer
4ifiRCSB PDB    PDBbind6-mer
4iknRCSB PDB    PDBbind6-mer
4j09RCSB PDB    PDBbind6-mer
4j77RCSB PDB    PDBbind6-mer
4j79RCSB PDB    PDBbind6-mer
4j86RCSB PDB    PDBbind6-mer
4j8bRCSB PDB    PDBbind6-mer
4jj7RCSB PDB    PDBbind6-mer
4jj8RCSB PDB    PDBbind6-mer
4jjeRCSB PDB    PDBbind6-mer
4jr0RCSB PDB    PDBbind6-mer
4k3oRCSB PDB    PDBbind6-mer
4k3pRCSB PDB    PDBbind6-mer
4k3qRCSB PDB    PDBbind6-mer
4k3rRCSB PDB    PDBbind6-mer
4ny3RCSB PDB    PDBbind6-mer
4o9wRCSB PDB    PDBbind6-mer
4ou3RCSB PDB    PDBbind6-mer
4tszRCSB PDB    PDBbind6-mer
4tt2RCSB PDB    PDBbind6-mer
4wk2RCSB PDB    PDBbind6-mer
4wvtRCSB PDB    PDBbind6-mer
4x9rRCSB PDB    PDBbind6-mer
4x9vRCSB PDB    PDBbind6-mer
4ynlRCSB PDB    PDBbind6-mer
5a2iRCSB PDB    PDBbind6-mer
5a2jRCSB PDB    PDBbind6-mer
5a2kRCSB PDB    PDBbind6-mer
5e1bRCSB PDB    PDBbind6-mer
5e1dRCSB PDB    PDBbind6-mer
5e1mRCSB PDB    PDBbind6-mer
5e1oRCSB PDB    PDBbind6-mer
5epkRCSB PDB    PDBbind6-mer
5eplRCSB PDB    PDBbind6-mer
5eq0RCSB PDB    PDBbind6-mer
5fotRCSB PDB    PDBbind6-mer
5fouRCSB PDB    PDBbind6-mer
5fovRCSB PDB    PDBbind6-mer
5fowRCSB PDB    PDBbind6-mer
5foxRCSB PDB    PDBbind6-mer
5fpkRCSB PDB    PDBbind6-mer
5gwzRCSB PDB    PDBbind6-mer
5hvpRCSB PDB    PDBbind6-mer
5izfRCSB PDB    PDBbind6-mer
5l7kRCSB PDB    PDBbind6-mer
5lrgRCSB PDB    PDBbind6-mer
5lrjRCSB PDB    PDBbind6-mer
5lrkRCSB PDB    PDBbind6-mer
5lsoRCSB PDB    PDBbind6-mer
5tpcRCSB PDB    PDBbind6-mer
5w94RCSB PDB    PDBbind6-mer
6aprRCSB PDB    PDBbind6-mer
6aszRCSB PDB    PDBbind6-mer
6at0RCSB PDB    PDBbind6-mer
6cgtRCSB PDB    PDBbind6-mer
7hvpRCSB PDB    PDBbind6-mer

Entry Information
PDB ID3u51
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameProto-oncogene tyrosine-protein Src kinase domain
Ligand Name6-mer
EC.Number E.C.2.7.10.2
Resolution 2.24(Å)
Affinity (Kd/Ki/IC50)Kd=3.1uM
Release Year2012
Protein/NA SequenceCheck fasta file
Primary Reference(2012) Nat.Chem.Biol. Vol. 8: pp. 366-374
Ligand Properties
Formula C38H51N9O7
Molecular Weight 745.868
Exact Mass 745.391
No. of atoms 105
No. of bonds 108
Polar Surface Area 243.47
LOGP Value 1.96      (Computed with XLOGP3)
3.22      (Computed with Open Babel)
Drug likenessNo. of Hydrogen Bond Donors: 7
No. of Hydrogen Bond Acceptors: 9
No. of Rotatable Bonds: 13
No. of Nitrogen and Oxygen Atoms: 16
No. of Rings: 4
Canonical SMILES
InChI String

Links to External Databases
RCSB PDBThe mother database
PDBsumEnhanced annotations on PDB entries
PubchemComprehensive collection of chemical and biological data
UniProtKB ACUniProt accession number (AC): P00523  
Entrez Gene IDNCBI Entrez Gene ID: 396442  
ASDInformation of known allosteric effects of PDB entries

 
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