eF-site ID 5fto-A
PDB Code 5fto
Chain A

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Title Crystal structure of the ALK kinase domain in complex with Entrectinib
Classification TRANSFERASE
Compound ALK TYROSINE KINASE RECEPTOR
Source Homo sapiens (Human) (ALK_HUMAN)
Sequence A:  GPNYCFAGKTSSISDLKEVPRKNITLIRGLGHGAFGEVYE
GQVSGMSPLQVAVKTLPEVCSEQDELDFLMEALIISKFNH
QNIVRCIGVSLQSLPRFILLELMAGGDLKSFLRETRPRPS
QPSSLAMLDLLHVARDIACGCQYLEENHFIHRDIAARNCL
LTCPGPGRVAKIGDFGMARDIYRGCAMLPVKWMPPEAFME
GIFTSKTDTWSFGVLLWEIFSLGYMPYPSKSNQEVLEFVT
SGGRMDPPKNCPGPVYRIMTQCWQHQPEDRPNFAIILERI
EYCTQDPDVINTALPIEY
Description


Functional site

1) chain A
residue 1122
type
sequence L
description BINDING SITE FOR RESIDUE YMX A 2402
source : AC1

2) chain A
residue 1123
type
sequence G
description BINDING SITE FOR RESIDUE YMX A 2402
source : AC1

3) chain A
residue 1127
type
sequence F
description BINDING SITE FOR RESIDUE YMX A 2402
source : AC1

4) chain A
residue 1130
type
sequence V
description BINDING SITE FOR RESIDUE YMX A 2402
source : AC1

5) chain A
residue 1148
type
sequence A
description BINDING SITE FOR RESIDUE YMX A 2402
source : AC1

6) chain A
residue 1196
type
sequence L
description BINDING SITE FOR RESIDUE YMX A 2402
source : AC1

7) chain A
residue 1197
type
sequence E
description BINDING SITE FOR RESIDUE YMX A 2402
source : AC1

8) chain A
residue 1199
type
sequence M
description BINDING SITE FOR RESIDUE YMX A 2402
source : AC1

9) chain A
residue 1200
type
sequence A
description BINDING SITE FOR RESIDUE YMX A 2402
source : AC1

10) chain A
residue 1201
type
sequence G
description BINDING SITE FOR RESIDUE YMX A 2402
source : AC1

11) chain A
residue 1202
type
sequence G
description BINDING SITE FOR RESIDUE YMX A 2402
source : AC1

12) chain A
residue 1203
type
sequence D
description BINDING SITE FOR RESIDUE YMX A 2402
source : AC1

13) chain A
residue 1253
type
sequence R
description BINDING SITE FOR RESIDUE YMX A 2402
source : AC1

14) chain A
residue 1254
type
sequence N
description BINDING SITE FOR RESIDUE YMX A 2402
source : AC1

15) chain A
residue 1256
type
sequence L
description BINDING SITE FOR RESIDUE YMX A 2402
source : AC1

16) chain A
residue 1269
type
sequence G
description BINDING SITE FOR RESIDUE YMX A 2402
source : AC1

17) chain A
residue 1270
type
sequence D
description BINDING SITE FOR RESIDUE YMX A 2402
source : AC1

18) chain A
residue 1122-1150
type prosite
sequence LGHGAFGEVYEGQVSGMSPLQVAVK
description PROTEIN_KINASE_ATP Protein kinases ATP-binding region signature. LGHGAFGEVYeGqvsgmpndpsplq.....VAVK
source prosite : PS00107

19) chain A
residue 1245-1257
type prosite
sequence FIHRDIAARNCLL
description PROTEIN_KINASE_TYR Tyrosine protein kinases specific active-site signature. FIHrDIAARNCLL
source prosite : PS00109

20) chain A
residue 1249
type ACT_SITE
sequence D
description Proton acceptor => ECO:0000255|PROSITE-ProRule:PRU00159, ECO:0000255|PROSITE-ProRule:PRU10028
source Swiss-Prot : SWS_FT_FI1

21) chain A
residue 1124
type BINDING
sequence H
description
source Swiss-Prot : SWS_FT_FI2

22) chain A
residue 1197
type BINDING
sequence E
description
source Swiss-Prot : SWS_FT_FI2

23) chain A
residue 1150
type BINDING
sequence K
description BINDING => ECO:0000255|PROSITE-ProRule:PRU00159
source Swiss-Prot : SWS_FT_FI3

24) chain A
residue 1270
type BINDING
sequence D
description BINDING => ECO:0000269|PubMed:20632993
source Swiss-Prot : SWS_FT_FI4

25) chain A
residue 1096
type MOD_RES
sequence Y
description Phosphotyrosine => ECO:0000269|PubMed:16878150, ECO:0007744|PubMed:15592455
source Swiss-Prot : SWS_FT_FI5

26) chain A
residue 1131
type MOD_RES
sequence Y
description Phosphotyrosine => ECO:0007744|PubMed:15592455
source Swiss-Prot : SWS_FT_FI6

27) chain A
residue 1278
type MOD_RES
sequence Y
description Phosphotyrosine => ECO:0000269|PubMed:15938644
source Swiss-Prot : SWS_FT_FI7


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