PDB entry 3qzq

View 3qzq on RCSB PDB site
Description: Human enterovirus 71 3C protease mutant E71D in complex with rupintrivir
Class: hydrolase/hydrolase inhibitor
Keywords: chymotrypsin-fold, beta-ribbon, hydrolysis, nucleus, HYDROLASE-HYDROLASE INHIBITOR complex
Deposited on 2011-03-07, released 2011-08-10
The last revision prior to the SCOPe 2.05 freeze date was dated 2011-09-28, with a file datestamp of 2011-09-23.
Experiment type: XRAY
Resolution: 1.7 Å
R-factor: 0.201
AEROSPACI score: 0.53 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: 3C protein
    Species: Human enterovirus 71 [TaxId:39054]
    Database cross-references and differences (RAF-indexed):
    • Uniprot E7E815
      • engineered mutation (74)
    Domains in SCOPe 2.05: d3qzqa_
  • Chain 'B':
    Compound: 3C protein
    Species: Human enterovirus 71 [TaxId:39054]
    Database cross-references and differences (RAF-indexed):
    • Uniprot E7E815
      • engineered mutation (74)
    Domains in SCOPe 2.05: d3qzqb_
  • Chain 'C':
    Compound: 3C protein
    Species: Human enterovirus 71 [TaxId:39054]
    Database cross-references and differences (RAF-indexed):
    • Uniprot E7E815
      • engineered mutation (74)
    Domains in SCOPe 2.05: d3qzqc_
  • Chain 'D':
    Compound: 3C protein
    Species: Human enterovirus 71 [TaxId:39054]
    Database cross-references and differences (RAF-indexed):
    • Uniprot E7E815
      • engineered mutation (74)
    Domains in SCOPe 2.05: d3qzqd_
  • Heterogens: AG7, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download) 
    >3qzqA (A:)
gshmgpsldfalsllrrnvrqvqtdqghftmlgvrdrlavlprhsqpgktiwiehklvnv
ldavelvdeqgvnldltlitldtnekfrditkfipenistasdatlvintehmpsmfvpv
gdvvqygflnlsgkpthrtmmynfptkagqcggvvtsvgkiigihiggngrqgfcaglkr
syfaseq

    Sequence, based on observed residues (ATOM records): (download) 
    >3qzqA (A:)
dfalsllrrnvrqvqtdqghftmlgvrdrlavlprhsqpgktiwiehklvnvldavelvd
eqgvnldltlitldtnekfrditkfipenistasdatlvintehmpsmfvpvgdvvqygf
lnlsgkpthrtmmynfptkagqcggvvtsvgkiigihiggngrqgfcaglkrsyfa

  • Chain 'B':
    Sequence, based on SEQRES records: (download) 
    >3qzqB (B:)
gshmgpsldfalsllrrnvrqvqtdqghftmlgvrdrlavlprhsqpgktiwiehklvnv
ldavelvdeqgvnldltlitldtnekfrditkfipenistasdatlvintehmpsmfvpv
gdvvqygflnlsgkpthrtmmynfptkagqcggvvtsvgkiigihiggngrqgfcaglkr
syfaseq

    Sequence, based on observed residues (ATOM records): (download) 
    >3qzqB (B:)
falsllrrnvrqvqtdqghftmlgvrdrlavlprhsqpgktiwiehklvnvldavelvde
qgvnldltlitldtnekfrditkfipenistasdatlvintehmpsmfvpvgdvvqygfl
nlsgkpthrtmmynfptkagqcggvvtsvgkiigihiggngrqgfcaglkrsyfas

  • Chain 'C':
    Sequence, based on SEQRES records: (download) 
    >3qzqC (C:)
gshmgpsldfalsllrrnvrqvqtdqghftmlgvrdrlavlprhsqpgktiwiehklvnv
ldavelvdeqgvnldltlitldtnekfrditkfipenistasdatlvintehmpsmfvpv
gdvvqygflnlsgkpthrtmmynfptkagqcggvvtsvgkiigihiggngrqgfcaglkr
syfaseq

    Sequence, based on observed residues (ATOM records): (download) 
    >3qzqC (C:)
sldfalsllrrnvrqvqtdqghftmlgvrdrlavlprhsqpgktiwiehklvnvldavel
vdeqgvnldltlitldtnekfrditkfipenistasdatlvintehmpsmfvpvgdvvqy
gflnlsgkpthrtmmynfptkagqcggvvtsvgkiigihiggngrqgfcaglkrsyfa

  • Chain 'D':
    Sequence, based on SEQRES records: (download) 
    >3qzqD (D:)
gshmgpsldfalsllrrnvrqvqtdqghftmlgvrdrlavlprhsqpgktiwiehklvnv
ldavelvdeqgvnldltlitldtnekfrditkfipenistasdatlvintehmpsmfvpv
gdvvqygflnlsgkpthrtmmynfptkagqcggvvtsvgkiigihiggngrqgfcaglkr
syfaseq

    Sequence, based on observed residues (ATOM records): (download) 
    >3qzqD (D:)
falsllrrnvrqvqtdqghftmlgvrdrlavlprhsqpgktiwiehklvnvldavelvde
qgvnldltlitldtnekfrditkfipenistasdatlvintehmpsmfvpvgdvvqygfl
nlsgkpthrtmmynfptkagqcggvvtsvgkiigihiggngrqgfcaglkrsyfa