eF-site ID 3n0b-C
PDB Code 3n0b
Chain C

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Title TM0449 mutant crystals grown in loops/micromounts
Classification TRANSFERASE
Compound Thymidylate synthase thyX
Source Thermotoga maritima (strain ATCC 43589 / MSB8 / DSM 3109 / JCM 10099) (THYX_THEMA)
Sequence C:  MKIDILDKGFVELVDVMGNDLSAVRAARVSFDDEERDRHL
IEYLMKHGHETPFEHIVFTFHVKAPIFVARQWFRHRIASY
NELSGRYSKLSYEFYIPSPERLEGYKTTIPPERVTEKISE
IVDKAYRTYLELIESGVPREVARIVLPLNLYTRAFATVNA
RSLMNFLNLRADSHAQWEIQQYALAIARIFKEKCPWTFEA
FLKYAYKGDILKEVQV
Description


Functional site
1) chain C
residue 78
type
sequence R
description BINDING SITE FOR RESIDUE FAD C 305
source : AC3
2) chain C
residue 79
type
sequence H
description BINDING SITE FOR RESIDUE FAD C 305
source : AC3
3) chain C
residue 80
type
sequence R
description BINDING SITE FOR RESIDUE FAD C 305
source : AC3
4) chain C
residue 81
type
sequence I
description BINDING SITE FOR RESIDUE FAD C 305
source : AC3
5) chain C
residue 169
type
sequence N
description BINDING SITE FOR RESIDUE FAD C 305
source : AC3
6) chain C
residue 173
type
sequence L
description BINDING SITE FOR RESIDUE FAD C 305
source : AC3
7) chain C
residue 174
type
sequence R
description BINDING SITE FOR RESIDUE FAD C 305
source : AC3
8) chain C
residue 178
type
sequence H
description BINDING SITE FOR RESIDUE FAD C 305
source : AC3
9) chain C
residue 74
type
sequence R
description BINDING SITE FOR RESIDUE UMP B 308
source : AC4
10) chain C
residue 75
type
sequence Q
description BINDING SITE FOR RESIDUE UMP B 308
source : AC4
11) chain C
residue 78
type
sequence R
description BINDING SITE FOR RESIDUE UMP B 308
source : AC4
12) chain C
residue 174
type
sequence R
description BINDING SITE FOR RESIDUE UMP B 308
source : AC4
13) chain C
residue 85
type
sequence N
description BINDING SITE FOR RESIDUE FAD B 310
source : AC5
14) chain C
residue 86
type
sequence E
description BINDING SITE FOR RESIDUE FAD B 310
source : AC5
15) chain C
residue 88
type
sequence S
description BINDING SITE FOR RESIDUE FAD B 310
source : AC5
16) chain C
residue 77
type
sequence F
description BINDING SITE FOR RESIDUE UMP C 313
source : AC6
17) chain C
residue 86
type
sequence E
description BINDING SITE FOR RESIDUE UMP C 313
source : AC6
18) chain C
residue 87
type
sequence L
description BINDING SITE FOR RESIDUE UMP C 313
source : AC6
19) chain C
residue 88
type
sequence S
description BINDING SITE FOR RESIDUE UMP C 313
source : AC6
20) chain C
residue 89
type
sequence G
description BINDING SITE FOR RESIDUE UMP C 313
source : AC6
21) chain C
residue 90
type
sequence R
description BINDING SITE FOR RESIDUE UMP C 313
source : AC6
22) chain C
residue 147
type
sequence R
description BINDING SITE FOR RESIDUE UMP C 313
source : AC6
23) chain C
residue 55
type
sequence T
description BINDING SITE FOR RESIDUE FAD A 315
source : AC7
24) chain C
residue 58
type
sequence E
description BINDING SITE FOR RESIDUE FAD A 315
source : AC7
25) chain C
residue 81
type
sequence I
description BINDING SITE FOR RESIDUE FAD A 315
source : AC7
26) chain C
residue 163
type
sequence N
description BINDING SITE FOR RESIDUE FAD A 315
source : AC7
27) chain C
residue 165
type
sequence R
description BINDING SITE FOR RESIDUE FAD A 315
source : AC7
28) chain C
residue 55
type BINDING
sequence T
description BINDING => ECO:0000269|PubMed:12791256, ECO:0000269|PubMed:19370033, ECO:0000269|PubMed:22477781, ECO:0000269|PubMed:23019356, ECO:0000269|PubMed:24563811, ECO:0000269|PubMed:27214228, ECO:0000269|PubMed:34315871, ECO:0007744|PDB:1O26, ECO:0007744|PDB:3G4A, ECO:0007744|PDB:3N0B, ECO:0007744|PDB:4GTD, ECO:0007744|PDB:4KAS, ECO:0007744|PDB:7NDW
source Swiss-Prot : SWS_FT_FI2
29) chain C
residue 75
type BINDING
sequence Q
description BINDING => ECO:0000269|PubMed:12791256, ECO:0000269|PubMed:19370033, ECO:0000269|PubMed:22477781, ECO:0000269|PubMed:23019356, ECO:0000269|PubMed:24563811, ECO:0000269|PubMed:27214228, ECO:0007744|PDB:1O26, ECO:0007744|PDB:3G4A, ECO:0007744|PDB:3N0B, ECO:0007744|PDB:4GT9, ECO:0007744|PDB:4KAS
source Swiss-Prot : SWS_FT_FI3
30) chain C
residue 174
type BINDING
sequence R
description BINDING => ECO:0000269|PubMed:12791256, ECO:0000269|PubMed:19370033, ECO:0000269|PubMed:22477781, ECO:0000269|PubMed:23019356, ECO:0000269|PubMed:24563811, ECO:0000269|PubMed:27214228, ECO:0007744|PDB:1O26, ECO:0007744|PDB:3G4A, ECO:0007744|PDB:3N0B, ECO:0007744|PDB:4GT9, ECO:0007744|PDB:4KAS
source Swiss-Prot : SWS_FT_FI3
31) chain C
residue 147
type BINDING
sequence R
description in other chain => ECO:0000269|PubMed:12791256, ECO:0000269|PubMed:19370033, ECO:0000269|PubMed:22477781, ECO:0000269|PubMed:23019356, ECO:0000269|PubMed:24563811, ECO:0000269|PubMed:27214228, ECO:0007744|PDB:1O26, ECO:0007744|PDB:3G4A, ECO:0007744|PDB:3N0B, ECO:0007744|PDB:4GT9, ECO:0007744|PDB:4KAS
source Swiss-Prot : SWS_FT_FI5
32) chain C
residue 174
type ACT_SITE
sequence R
description Involved in ionization of N3 of dUMP, leading to its activation => ECO:0000269|PubMed:27214228
source Swiss-Prot : SWS_FT_FI1
33) chain C
residue 86
type BINDING
sequence E
description BINDING => ECO:0000269|PubMed:12211025, ECO:0000269|PubMed:12791256, ECO:0000269|PubMed:19370033, ECO:0000269|PubMed:22477781, ECO:0000269|PubMed:23019356, ECO:0000269|PubMed:24563811, ECO:0000269|PubMed:27214228, ECO:0000269|PubMed:34315871, ECO:0007744|PDB:1KQ4, ECO:0007744|PDB:1O26, ECO:0007744|PDB:3G4A, ECO:0007744|PDB:3N0B, ECO:0007744|PDB:4GTD, ECO:0007744|PDB:4KAS, ECO:0007744|PDB:7NDW
source Swiss-Prot : SWS_FT_FI4
34) chain C
residue 163
type BINDING
sequence N
description BINDING => ECO:0000269|PubMed:12211025, ECO:0000269|PubMed:12791256, ECO:0000269|PubMed:19370033, ECO:0000269|PubMed:22477781, ECO:0000269|PubMed:23019356, ECO:0000269|PubMed:24563811, ECO:0000269|PubMed:27214228, ECO:0000269|PubMed:34315871, ECO:0007744|PDB:1KQ4, ECO:0007744|PDB:1O26, ECO:0007744|PDB:3G4A, ECO:0007744|PDB:3N0B, ECO:0007744|PDB:4GTD, ECO:0007744|PDB:4KAS, ECO:0007744|PDB:7NDW
source Swiss-Prot : SWS_FT_FI4
35) chain C
residue 169
type BINDING
sequence N
description BINDING => ECO:0000269|PubMed:12211025, ECO:0000269|PubMed:12791256, ECO:0000269|PubMed:19370033, ECO:0000269|PubMed:22477781, ECO:0000269|PubMed:23019356, ECO:0000269|PubMed:24563811, ECO:0000269|PubMed:27214228, ECO:0000269|PubMed:34315871, ECO:0007744|PDB:1KQ4, ECO:0007744|PDB:1O26, ECO:0007744|PDB:3G4A, ECO:0007744|PDB:3N0B, ECO:0007744|PDB:4GTD, ECO:0007744|PDB:4KAS, ECO:0007744|PDB:7NDW
source Swiss-Prot : SWS_FT_FI4
36) chain C
residue 78
type BINDING
sequence R
description BINDING => ECO:0000269|PubMed:12211025, ECO:0000269|PubMed:12791256, ECO:0000269|PubMed:19370033, ECO:0000269|PubMed:22477781, ECO:0000269|PubMed:23019356, ECO:0000269|PubMed:24563811, ECO:0000269|PubMed:27214228, ECO:0000269|PubMed:34315871, ECO:0007744|PDB:1KQ4, ECO:0007744|PDB:1O26, ECO:0007744|PDB:3G4A, ECO:0007744|PDB:3N0B, ECO:0007744|PDB:4GTD, ECO:0007744|PDB:4KAS, ECO:0007744|PDB:7NDW
source Swiss-Prot : SWS_FT_FI4

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