-OEChem-03101014063D

  5  4  0     0  0  0  0  0  0999 V2000
    9.9720   52.9110   10.3150 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6780   52.0840    8.3610 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.4630   53.0970    9.2010 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0170   51.4250    8.3220 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5720   51.5900    7.4880 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  2  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  5  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_MMDB_MOLECULE_NAME>
DMF

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_SUBSTANCE_ID>
26719339

> <PUBCHEM_SUBSTANCE_VERSION>
6

> <PUBCHEM_EXT_DATASOURCE_NAME>
MMDB

> <PUBCHEM_EXT_DATASOURCE_REGID>
3366.5

> <PUBCHEM_SUBSTANCE_COMMENT>
PDB Accession Code 7EST
Interaction Of The Peptide Cf3-Leu-Ala-Nh-C6h4-Cf3(Tfla) With Porcine Pancreatic Elastase. X-Ray Studies At 1.8 Angstroms
Hydrolase (Serine Proteinase)
Interaction Of The Peptide Cf3-Leu-Ala-Nh-C6h4-Cf3(Tfla) With Porcine Pancreatic Elastase. X-Ray Studies At 1.8 Angstroms Hydrolase (Serine Proteinase) Mol_id: 1; Molecule: Elastase; Chain: E; Ec: 3.4.21.36; Engineered: Yes; Mol_id: 2; Molecule: Trifluoroacetyl-L-Leucyl-L-Alanyl-P- Trifluoromethylphenylanilide; Chain: I; Engineered: Yes

> <PUBCHEM_SUBSTANCE_SYNONYM>
DMF

> <PUBCHEM_XREF_EXT_ID>
3366.5

> <PUBCHEM_NCBI_MMDB_ID>
3366

> <PUBCHEM_EXT_DATASOURCE_URL>
http://www.ncbi.nlm.nih.gov/Structure/MMDB/mmdb.shtml

> <PUBCHEM_EXT_SUBSTANCE_URL>
http://www.ncbi.nlm.nih.gov/Structure/mmdb/mmdbsrv.cgi?uid=3366

> <PUBCHEM_CID_ASSOCIATIONS>
6228  1

> <PUBCHEM_CONFORMER_ID>
0197B46B00060001

> <PUBCHEM_COORDINATE_TYPE>
2
3
4

$$$$