eF-site ID 1bra-A
PDB Code 1bra
Chain A

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Title RELOCATING A NEGATIVE CHARGE IN THE BINDING POCKET OF TRYPSIN
Classification PROTEINASE/INHIBITOR
Compound TRYPSIN
Source null (TRY2_RAT)
Sequence A:  IVGGYTCQENSVPYQVSLNSGYHFCGGSLINDQWVVSAAH
CYKSRIQVRLGEHNINVLEGNEQFVNAAKIIKHPNFDRKT
LNNDIMLIKLSSPVKLNARVATVALPSSCAPAGTQCLISG
WGNTLSSGVNEPDLLQCLDAPLLPQADCEASYPGKITDNM
VCVGFLEGGKGSCQGDSGGPVVCNGELQGIVSWGYGCALP
DNPDVYTKVCNYVDWIQDTIAAN
Description (1)  TRYPSIN (E.C.3.4.21.4) VARIANT (D189G,G226D) COMPLEXED WITH BENZAMIDINE


Functional site

1) chain A
residue 57
type
sequence H
description CATALYTIC TRIAD RESIDUES, CONSERVED IN ALL SERINE PROTEASES OF THE TRYPSIN AND SUBTILISIN STRUCTURAL CLASSES
source : CAT

2) chain A
residue 102
type
sequence D
description CATALYTIC TRIAD RESIDUES, CONSERVED IN ALL SERINE PROTEASES OF THE TRYPSIN AND SUBTILISIN STRUCTURAL CLASSES
source : CAT

3) chain A
residue 195
type
sequence S
description CATALYTIC TRIAD RESIDUES, CONSERVED IN ALL SERINE PROTEASES OF THE TRYPSIN AND SUBTILISIN STRUCTURAL CLASSES
source : CAT

4) chain A
residue 70
type
sequence E
description BINDING SITE FOR RESIDUE CA A 302
source : AC1

5) chain A
residue 72
type
sequence N
description BINDING SITE FOR RESIDUE CA A 302
source : AC1

6) chain A
residue 75
type
sequence V
description BINDING SITE FOR RESIDUE CA A 302
source : AC1

7) chain A
residue 77
type
sequence E
description BINDING SITE FOR RESIDUE CA A 302
source : AC1

8) chain A
residue 80
type
sequence E
description BINDING SITE FOR RESIDUE CA A 302
source : AC1

9) chain A
residue 190
type
sequence S
description BINDING SITE FOR RESIDUE BEN A 246
source : AC2

10) chain A
residue 192
type
sequence Q
description BINDING SITE FOR RESIDUE BEN A 246
source : AC2

11) chain A
residue 195
type
sequence S
description BINDING SITE FOR RESIDUE BEN A 246
source : AC2

12) chain A
residue 213
type
sequence V
description BINDING SITE FOR RESIDUE BEN A 246
source : AC2

13) chain A
residue 214
type
sequence S
description BINDING SITE FOR RESIDUE BEN A 246
source : AC2

14) chain A
residue 216
type
sequence G
description BINDING SITE FOR RESIDUE BEN A 246
source : AC2

15) chain A
residue 219
type
sequence G
description BINDING SITE FOR RESIDUE BEN A 246
source : AC2

16) chain A
residue 226
type
sequence D
description BINDING SITE FOR RESIDUE BEN A 246
source : AC2

17) chain A
residue 53-58
type prosite
sequence VSAAHC
description TRYPSIN_HIS Serine proteases, trypsin family, histidine active site. VSAAHC
source prosite : PS00134

18) chain A
residue 189-200
type prosite
sequence GSCQGDSGGPVV
description TRYPSIN_SER Serine proteases, trypsin family, serine active site. GScqGDSGGPVV
source prosite : PS00135

19) chain A
residue 57
type ACT_SITE
sequence H
description Charge relay system
source Swiss-Prot : SWS_FT_FI1

20) chain A
residue 102
type ACT_SITE
sequence D
description Charge relay system
source Swiss-Prot : SWS_FT_FI1

21) chain A
residue 195
type ACT_SITE
sequence S
description Charge relay system
source Swiss-Prot : SWS_FT_FI1

22) chain A
residue 75
type BINDING
sequence V
description
source Swiss-Prot : SWS_FT_FI2

23) chain A
residue 80
type BINDING
sequence E
description
source Swiss-Prot : SWS_FT_FI2

24) chain A
residue 70
type BINDING
sequence E
description
source Swiss-Prot : SWS_FT_FI2

25) chain A
residue 72
type BINDING
sequence N
description
source Swiss-Prot : SWS_FT_FI2

26) chain A
residue 189
type SITE
sequence G
description Required for specificity => ECO:0000250
source Swiss-Prot : SWS_FT_FI3


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