eF-site ID 4w8d-A
PDB Code 4w8d
Chain A

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Title Crystal structure of MST3 with a pyrrolopyrimidine inhibitor (PF-06454589).
Classification transferase/transferase inhibitor
Compound Serine/threonine-protein kinase 24 36 kDa subunit
Source Homo sapiens (Human) (STK24_HUMAN)
Sequence A:  GLPGMQNLKADPEELFTKLEKIGKGSFGEVFKGIDNRTQK
VVAIKIIDLEEAEDEIEDIQQEITVLSQCDSPYVTKYYGS
YLKDTKLWIIMEYLGGGSALDLLEPGPLDETQIATILREI
LKGLDYLHSEKKIHRDIKAANVLLSEHGEVKLADFGVAGQ
LTDTQIKRNXFVGTPFWMAPEVIKQSAYDSKADIWSLGIT
AIELARGEPPHSELHPMKVLFLIPKNNPPTLEGNYSKPLK
EFVEACLNKEPSFRPTAKELLKHKFILRNAKKTSYLTELI
DRYKRWKAEQ
Description


Functional site

1) chain A
residue 30
type
sequence I
description binding site for residue 3JA A 500
source : AC1

2) chain A
residue 31
type
sequence G
description binding site for residue 3JA A 500
source : AC1

3) chain A
residue 32
type
sequence K
description binding site for residue 3JA A 500
source : AC1

4) chain A
residue 51
type
sequence A
description binding site for residue 3JA A 500
source : AC1

5) chain A
residue 100
type
sequence E
description binding site for residue 3JA A 500
source : AC1

6) chain A
residue 101
type
sequence Y
description binding site for residue 3JA A 500
source : AC1

7) chain A
residue 102
type
sequence L
description binding site for residue 3JA A 500
source : AC1

8) chain A
residue 149
type
sequence N
description binding site for residue 3JA A 500
source : AC1

9) chain A
residue 151
type
sequence L
description binding site for residue 3JA A 500
source : AC1

10) chain A
residue 42
type BINDING
sequence I
description
source Swiss-Prot : SWS_FT_FI2

11) chain A
residue 65
type BINDING
sequence E
description
source Swiss-Prot : SWS_FT_FI2

12) chain A
residue 112
type BINDING
sequence E
description
source Swiss-Prot : SWS_FT_FI2

13) chain A
residue 161
type BINDING
sequence A
description
source Swiss-Prot : SWS_FT_FI2

14) chain A
residue 174
type BINDING
sequence I
description
source Swiss-Prot : SWS_FT_FI2

15) chain A
residue 30-53
type prosite
sequence IGKGSFGEVFKGIDNRTQKVVAIK
description PROTEIN_KINASE_ATP Protein kinases ATP-binding region signature. IGKGSFGEVFkGidnrtqkv..........VAIK
source prosite : PS00107

16) chain A
residue 156
type ACT_SITE
sequence G
description Proton acceptor => ECO:0000255|PROSITE-ProRule:PRU00159
source Swiss-Prot : SWS_FT_FI1

17) chain A
residue 18
type MOD_RES
sequence A
description Phosphothreonine; by PKA => ECO:0000269|PubMed:10644707
source Swiss-Prot : SWS_FT_FI3

18) chain A
residue 190
type MOD_RES
sequence V
description Phosphothreonine; by autocatalysis => ECO:0000269|PubMed:17046825, ECO:0000269|PubMed:19604147, ECO:0000269|PubMed:20124694, ECO:0007744|PubMed:23186163
source Swiss-Prot : SWS_FT_FI4


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