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Enzyme   3.4.21.62
Classification complex(serine proteinase-inhibitor)    | release date: Fri, Jun 3, 1988
Title the high-resolution x-ray crystal structure of the complex formed between subtilisin carlsberg and eglin c, an elastase inhibitor from the leech hirudo medicinalis. structural analysis, subtilisin structure and interface geometry
Authors W.BODE
Method X-RAY DIFFRACTION (resolution: 1.20Å)
PDBe Citation   
Small molecules:    search CA CA binding statistics CA
Ligand bond colours:   *  covalent   *  ionic   *  hydrogen   *  electrostatic   *  van-der-waals   *  plane-atom   *  plane-plane   *  undefined  - Click here to show 5Å bonds
Chain E sequence:
AQTVPYGIPLIKADKVQAQGFKGANVKVAVLDTGIQASHPDLNVVGGASFVAGEAYNTDGNGHGTHVAGTVAALDNTTGV
LGVAPSVSLYAVKVLNSSGSGSYSGIVSGIEWATTNGMDVINMSLGGASGSTAMKQAVDNAYARGVVVVAAAGNSGNSGS
TNTIGYPAKYDSVIAVGAVDSNSNRASFSSVGAELEVMAPGAGVYSTYPTNTYATLNGTSMASPHVAGAAALILSKHPNL
SASQVRNRLSSTATYLGSSFYYGKGLINVEAAAQ
Chain I sequence:
TEFGSELKSFPEVVGKTVDQAREYFTLHYPQYNVYFLPEGSPVTLDLRYNRVRVFYNPGTNVVNHVPHVG
Residue colours:  hydrophilic   hydrophobic   intermediate 
Assembly 1     View the assembly/model: ( JMolViewer Download PDB file RasMol script viewer AstexViewer™@MSD-EBI )
Motif search   chain:    Sequence numbers: 
   Using:   φ/ψ    residues code    secondary structures   
 coordinates of:  Cαs Side-chain
 
      View the fragment: rasmol script JMol viewer
chain E : SUBTILISIN CARLSBERG
member of: CATH:search3.40.50.200GENE3D:searchG3DSA_3.40.50.200PANTHER:searchPTHR10795/searchPTHR10795_SF326PFAM:searchPF00082PRINTS:searchSUBTILISINPROSITE PATTERNS:searchPS00136/searchPS00137/searchPS00138, SUPERFAMILY:searchSSF52743UniProt:searchB0FXJ2
JMol viewer RasMol script viewer  CA 430E  .. *                                      *                                * * * *                                                                                                                                                                                                  
JMol viewer RasMol script viewer  CA 401E  .. |                                      |                                | | | |                                                                                       * *  *                                                                                                     
sec str:  .......hhhhhhhhhhhhhh......eeeeeee..........eeeeeeee...........hhhhhhhhhhhh..............eeeeeee.......hhhhhhhhhhhhhhh..eeeee.......hhhhhhhhhhhhhhh.eeeeee.....................eeeeee................eeeeee.................hhhhhhhhhhhhhhhhhhh...hhhhhhhhhhhh...........eeeehhhhhh.
sequence :  ..AQTVPYGIPLIKADKVQAQGFKGANVKVAVLDTGIQASHPDLNVVGGASFVAGEAYNTDGNGHGTHVAGTVAALDNTTGVLGVAPSVSLYAVKVLNSSGSGSYSGIVSGIEWATTNGMDVINMSLGGASGSTAMKQAVDNAYARGVVVVAAAGNSGNSGSTNTIGYPAKYDSVIAVGAVDSNSNRASFSSVGAELEVMAPGAGVYSTYPTNTYATLNGTSMASPHVAGAAALILSKHPNLSASQVRNRLSSTATYLGSSFYYGKGLINVEAAAQ
seq num:  ..1         11        21        31        41        51        62        72        82        92        102       112       122       132       142       152       162       172       182       192       202       212       222       232       242       252       262       272 
search RasMol script viewer Motif-ligand binding stats  ASN_GLYCOSYLATION ..        | |||| || |||||| | |   | | | || ||      | |  |     ||||||   ||  || ^***  | |  |        ^***|||   | ||||  | | |   ^***|    |   |     || |||      |    || || |  |  |  |   |    |||||  |  |  |    |||||   |        ^***  |    |        | ^***  |    |  |        |  |  | | |  
search RasMol script viewer Motif-ligand binding stats  PKC_PHOSPHO_SITE ..        | |||| || |||||| | |   | | | || ||      | |  |     ||||||   ||  ||       | |  |        | |||||   | ||||  | | |       |    |   |     || |||      |    || || |  |  |  |   |    |^**|  |  |  |    |||||   |         | |  |    |        |  ||   |    |  |        |  |  | | |  
search RasMol script viewer Motif-ligand binding stats  CK2_PHOSPHO_SITE ..        | |||| || |||||| | |   | | | ^***|      | |  |     ||||||   ||  ||       | |  |        | |||||   | ^***  | | |       |    |   |     || |||      |    || || |  |  |  |   |    | | |  |  |  |    |||||   |         | |  |    |        |  ||   |    |  |        |  |  | | |  
search RasMol script viewer Motif-ligand binding stats  TYR_PHOSPHO_SITE ..        | |||| || |||||| | |   | | |  |  |      | |  |     ||||||   ||  ||       | |  |        | |||||   |  ||   | | |       |    |   *******^ |||      |    || || |  |  |  |   |    | | |  |  |  |    |||||   |         | |  |    |        |  ||   |    |  |        |  |  | | |  
search RasMol script viewer Motif-ligand binding stats  MYRISTYL ..        | |||| || |||||| | |   | ^*****  |      | |  |     ^*****   ^*****       ^*****        | |||^*****  ^***** | |       ^*****   |     || |||      ^*****^*****  |  |  |   ^***** | |  |  |  |    |||^*****         ^*****    |        |  ||   |    |  |        |  |  | | |  
search RasMol script viewer Motif-ligand binding stats  SUBTILASE_ASP ..        | |||| || |||||| | ****^*******  |      | |  |      ||||     |  |          |  |        | ||| |   |   |   | | |            |   |     || |||            | || |  |  |  |        | | |  |  |  |    ||| |             | |       |        |  ||   |    |  |        |  |  | | |  
search RasMol script viewer Motif-ligand binding stats  SUBTILASE_HIS ..        | |||| || |||||| |         |  |  |      | |  |      ||^**********          |  |        | ||| |   |   |   | | |            |   |     || |||            | || |  |  |  |        | | |  |  |  |    ||| |             | |       |        |  ||   |    |  |        |  |  | | |  
search RasMol script viewer Motif-ligand binding stats  SUBTILASE_SER ..        | |||| || |||||| |         |  |  |      | |  |      ||||     |  |          |  |        | ||| |   |   |   | | |            |   |     || |||            | || |  |  |  |        | | |  |  |  |    ||| |             **^********        |  ||   |    |  |        |  |  | | |  
search RasMol script viewer Motif-ligand binding stats  asxmotif ..        | |||| || |||||| |         |  |  |      | |  |      ||||     |  |          |  |        | ||| |   |   |   | | |            |   |     || |||            | || |  |  |  |        | | |  |  |  |    ||| |                                |  ||   |    |  |        |  |  *****  
search RasMol script viewer Motif-ligand binding stats  asxturn ..        | |||| || |||||| |         |  |  |      | |  |      ***|     |  |          |  |        | ||| |   |   |   | | |            |   |     || |||            | |***  |  |  |        | | |  |  |  |    ||| |                                |  ||   |    |  |        |  |  ***    
search RasMol script viewer Motif-ligand binding stats  betaturn ..        ****|| |****||****         |  |  |      | ****      ||||     |  |          |  |        ****| |   |   |   | | |            |   |     |****|            | || |  |  |  |        | | ****  |  |    ||| |                                |  ||   |    |  |        ****         
search RasMol script viewer Motif-ligand binding stats  nest ..          **** |  ****** |         |  |  |      | |  |      ****     |  |          |  |          *** |   |   |   | ***            |   |     |  ***            | || |  |  |  |        *** |  |  |  |    ||| |                                |  ||   |    |  |                     
search RasMol script viewer Motif-ligand binding stats  niche ..               |    | ****         *******      | ****               ****          ****              |   |   |   |                |   |     |    |            ******  *******            ****  ****    *****                                ****|   |    ****                     
search RasMol script viewer Motif-ligand binding stats  schellmannloop ..               ******                           | |                                                  |   |   |   |                |   |     ******                                                                                              |   |                             
search RasMol script viewer Motif-ligand binding stats  stmotif ..                                                | |                                                  *****   |   |                *****                                                                                                         *****                             
search RasMol script viewer Motif-ligand binding stats  ststaple ..                                                | |                                                          *****                                                                                                                                                                
search RasMol script viewer Motif-ligand binding stats  stturn ..                                                ***                                                                                                                                                                                                                               

chain I : EGLIN C
member of: CATH:search3.30.10.10GENE3D:searchG3DSA_3.30.10.10PFAM:searchPF00280PRINTS:searchPOTATOINHBTRPRODOM:searchPD002604PROSITE PATTERNS:searchPS00285, SUPERFAMILY:searchSSF54654UniProt:searchP01051
sec str:  ..eeehhhh..hhhhhhhhhhhhh...eeeee.............eeeeee........eeeeee
sequence :  ..KSFPEVVGKTVDQAREYFTLHYPQYNVYFLPEGSPVTLDLRYNRVRVFYNPGTNVVNHVPHVG
seq num:  ..8         18        28        38        48        58        68 
search RasMol script viewer Motif-ligand binding stats  CK2_PHOSPHO_SITE .. ^***|| || | |       |  |     | ||   |  |  |       ||||        
search RasMol script viewer Motif-ligand binding stats  MYRISTYL ..  || || || | |       |  |     | ^*****  |  |       ||||        
search RasMol script viewer Motif-ligand binding stats  POTATO_INHIBITOR ..  ************       |  |     |  |      |  |       ||||        
search RasMol script viewer Motif-ligand binding stats  betaturn ..   | || || |         |  |     ****      |  |       ||||        
search RasMol script viewer Motif-ligand binding stats  nest ..   | || || |         |  |     |  |      |  |       ****        
search RasMol script viewer Motif-ligand binding stats  niche ..   ******| |         ****     ****      ****        | |        
search RasMol script viewer Motif-ligand binding stats  stturn ..         ***                                        ***        

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