2QC8

Crystal structure of human glutamine synthetase in complex with ADP and methionine sulfoximine phosphate

> Summary

Summary for 2QC8

Related2OJW
DescriptorGlutamine synthetase (E.C.6.3.1.2)
Functional Keywordsamino-acid biosynthesis, ligase, synthetase, structural genomics, structural genomics consortium, sgc
Biological sourceHomo sapiens (human)
Cellular locationCytoplasm P15104
Total number of polymer chains10
Total molecular weight442528.16
Authors
Primary citation
Krajewski, W.W.,Collins, R.,Holmberg-Schiavone, L.,Jones, T.A.,Karlberg, T.,Mowbray, S.L.
Crystal structures of mammalian glutamine synthetases illustrate substrate-induced conformational changes and provide opportunities for drug and herbicide design.
J.Mol.Biol., 375:217-228, 2008
PubMed: 18005987
DOI: 10.1016/j.jmb.2007.10.029
MImport into Mendeley
Experimental method
X-RAY DIFFRACTION (2.6 Å)
?

Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers0.22130.1%2.0%5.3%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution

More Asymmetric unit images

Molmil generated image of 2qc8
no rotation
Molmil generated image of 2qc8
rotated about x axis by 90°
Molmil generated image of 2qc8
rotated about y axis by 90°

> Structural details

Entity

Chain IDDescriptionTypeChain lengthFormula weightNumber of moleculesDB Name (Accession)Biological sourceDescriptive keywords
A, B, C, D, E...Glutamine synthetasepolymer38443365.110
UniProt (P15104)
Pfam (PF00120)
Pfam (PF03951)
Homo sapiens (human)@PDBjGlutamate-ammonia ligase, GS
MANGANESE (II) IONnon-polymer54.930
CHLORIDE IONnon-polymer35.510
ADENOSINE-5'-DIPHOSPHATEnon-polymer427.210
L-METHIONINE-S-SULFOXIMINE PHOSPHATEnon-polymer260.210
waterwater18.0231

Sequence viewer

Contents of the asymmetric unit

PolymersNumber of chains10
Total molecular weight433651.5
Non-Polymers*Number of molecules60
Total molecular weight8876.7
All*Total molecular weight442528.2
*Water molecules are not included.

> Experimental details

Refinement Statistics

Experimental method:X-RAY DIFFRACTION (2.6 Å)

Cell axes181.210126.080188.170
Cell angles90.0092.1490.00
SpacegroupC 1 2 1
Resolution limits39.94 - 2.60
the highest resolution shell value2.670 - 2.600
R-factor0.168
R-work0.16600
the highest resolution shell value0.239
R-free0.21700
the highest resolution shell value0.300
RMSD bond length0.015
RMSD bond angle1.592

Data Collection Statistics

Resolution limits40.00 - 2.60
the highest resolution shell value -
Number of reflections129787
Rmerge_l_obs0.120
the highest resolution shell value0.526
Completeness99.8
Redundancy7.5
the highest resolution shell value7.2
I/sigma(I)0

Crystallization Conditions

crystal IDmethodpHpH rangetemperatureunit
17298

Crystallization Reagents

IDcrystal IDsolution IDreagent nameconcentrationdetails
Crystallization Reagents in Literatures*
IDcrystal IDsolutionreagent nameconcentration (unit)details
Annotated Information is extracted from Literature Info*

> Functional details

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Functional Information from GO Data

ChainGOidnamespacecontents
A0043679cellular_componentaxon terminus
A0005737cellular_componentcytoplasm
A0005829cellular_componentcytosol
A0070062cellular_componentextracellular exosome
A0097386cellular_componentglial cell projection
A0005739cellular_componentmitochondrion
A0043209cellular_componentmyelin sheath
A0005634cellular_componentnucleus
A0043204cellular_componentperikaryon
A0043234cellular_componentprotein complex
A0005791cellular_componentrough endoplasmic reticulum
A0005524molecular_functionATP binding
A0016595molecular_functionglutamate binding
A0004351molecular_functionglutamate decarboxylase activity
A0004356molecular_functionglutamate-ammonia ligase activity
A0000287molecular_functionmagnesium ion binding
A0030145molecular_functionmanganese ion binding
A0019676biological_processammonia assimilation cycle
A0008283biological_processcell proliferation
A0008652biological_processcellular amino acid biosynthetic process
A0009267biological_processcellular response to starvation
A0006538biological_processglutamate catabolic process
A0006542biological_processglutamine biosynthetic process
A0001504biological_processneurotransmitter uptake
A0050679biological_processpositive regulation of epithelial cell proliferation
A0032024biological_processpositive regulation of insulin secretion
A0051968biological_processpositive regulation of synaptic transmission, glutamatergic
A0051260biological_processprotein homooligomerization
A0009749biological_processresponse to glucose
B0043679cellular_componentaxon terminus
B0005737cellular_componentcytoplasm
B0005829cellular_componentcytosol
B0070062cellular_componentextracellular exosome
B0097386cellular_componentglial cell projection
B0005739cellular_componentmitochondrion
B0043209cellular_componentmyelin sheath
B0005634cellular_componentnucleus
B0043204cellular_componentperikaryon
B0043234cellular_componentprotein complex
B0005791cellular_componentrough endoplasmic reticulum
B0005524molecular_functionATP binding
B0016595molecular_functionglutamate binding
B0004351molecular_functionglutamate decarboxylase activity
B0004356molecular_functionglutamate-ammonia ligase activity
B0000287molecular_functionmagnesium ion binding
B0030145molecular_functionmanganese ion binding
B0019676biological_processammonia assimilation cycle
B0008283biological_processcell proliferation
B0008652biological_processcellular amino acid biosynthetic process
B0009267biological_processcellular response to starvation
B0006538biological_processglutamate catabolic process
B0006542biological_processglutamine biosynthetic process
B0001504biological_processneurotransmitter uptake
B0050679biological_processpositive regulation of epithelial cell proliferation
B0032024biological_processpositive regulation of insulin secretion
B0051968biological_processpositive regulation of synaptic transmission, glutamatergic
B0051260biological_processprotein homooligomerization
B0009749biological_processresponse to glucose
C0043679cellular_componentaxon terminus
C0005737cellular_componentcytoplasm
C0005829cellular_componentcytosol
C0070062cellular_componentextracellular exosome
C0097386cellular_componentglial cell projection
C0005739cellular_componentmitochondrion
C0043209cellular_componentmyelin sheath
C0005634cellular_componentnucleus
C0043204cellular_componentperikaryon
C0043234cellular_componentprotein complex
C0005791cellular_componentrough endoplasmic reticulum
C0005524molecular_functionATP binding
C0016595molecular_functionglutamate binding
C0004351molecular_functionglutamate decarboxylase activity
C0004356molecular_functionglutamate-ammonia ligase activity
C0000287molecular_functionmagnesium ion binding
C0030145molecular_functionmanganese ion binding
C0019676biological_processammonia assimilation cycle
C0008283biological_processcell proliferation
C0008652biological_processcellular amino acid biosynthetic process
C0009267biological_processcellular response to starvation
C0006538biological_processglutamate catabolic process
C0006542biological_processglutamine biosynthetic process
C0001504biological_processneurotransmitter uptake
C0050679biological_processpositive regulation of epithelial cell proliferation
C0032024biological_processpositive regulation of insulin secretion
C0051968biological_processpositive regulation of synaptic transmission, glutamatergic
C0051260biological_processprotein homooligomerization
C0009749biological_processresponse to glucose
D0043679cellular_componentaxon terminus
D0005737cellular_componentcytoplasm
D0005829cellular_componentcytosol
D0070062cellular_componentextracellular exosome
D0097386cellular_componentglial cell projection
D0005739cellular_componentmitochondrion
D0043209cellular_componentmyelin sheath
D0005634cellular_componentnucleus
D0043204cellular_componentperikaryon
D0043234cellular_componentprotein complex
D0005791cellular_componentrough endoplasmic reticulum
D0005524molecular_functionATP binding
D0016595molecular_functionglutamate binding
D0004351molecular_functionglutamate decarboxylase activity
D0004356molecular_functionglutamate-ammonia ligase activity
D0000287molecular_functionmagnesium ion binding
D0030145molecular_functionmanganese ion binding
D0019676biological_processammonia assimilation cycle
D0008283biological_processcell proliferation
D0008652biological_processcellular amino acid biosynthetic process
D0009267biological_processcellular response to starvation
D0006538biological_processglutamate catabolic process
D0006542biological_processglutamine biosynthetic process
D0001504biological_processneurotransmitter uptake
D0050679biological_processpositive regulation of epithelial cell proliferation
D0032024biological_processpositive regulation of insulin secretion
D0051968biological_processpositive regulation of synaptic transmission, glutamatergic
D0051260biological_processprotein homooligomerization
D0009749biological_processresponse to glucose
E0043679cellular_componentaxon terminus
E0005737cellular_componentcytoplasm
E0005829cellular_componentcytosol
E0070062cellular_componentextracellular exosome
E0097386cellular_componentglial cell projection
E0005739cellular_componentmitochondrion
E0043209cellular_componentmyelin sheath
E0005634cellular_componentnucleus
E0043204cellular_componentperikaryon
E0043234cellular_componentprotein complex
E0005791cellular_componentrough endoplasmic reticulum
E0005524molecular_functionATP binding
E0016595molecular_functionglutamate binding
E0004351molecular_functionglutamate decarboxylase activity
E0004356molecular_functionglutamate-ammonia ligase activity
E0000287molecular_functionmagnesium ion binding
E0030145molecular_functionmanganese ion binding
E0019676biological_processammonia assimilation cycle
E0008283biological_processcell proliferation
E0008652biological_processcellular amino acid biosynthetic process
E0009267biological_processcellular response to starvation
E0006538biological_processglutamate catabolic process
E0006542biological_processglutamine biosynthetic process
E0001504biological_processneurotransmitter uptake
E0050679biological_processpositive regulation of epithelial cell proliferation
E0032024biological_processpositive regulation of insulin secretion
E0051968biological_processpositive regulation of synaptic transmission, glutamatergic
E0051260biological_processprotein homooligomerization
E0009749biological_processresponse to glucose
F0043679cellular_componentaxon terminus
F0005737cellular_componentcytoplasm
F0005829cellular_componentcytosol
F0070062cellular_componentextracellular exosome
F0097386cellular_componentglial cell projection
F0005739cellular_componentmitochondrion
F0043209cellular_componentmyelin sheath
F0005634cellular_componentnucleus
F0043204cellular_componentperikaryon
F0043234cellular_componentprotein complex
F0005791cellular_componentrough endoplasmic reticulum
F0005524molecular_functionATP binding
F0016595molecular_functionglutamate binding
F0004351molecular_functionglutamate decarboxylase activity
F0004356molecular_functionglutamate-ammonia ligase activity
F0000287molecular_functionmagnesium ion binding
F0030145molecular_functionmanganese ion binding
F0019676biological_processammonia assimilation cycle
F0008283biological_processcell proliferation
F0008652biological_processcellular amino acid biosynthetic process
F0009267biological_processcellular response to starvation
F0006538biological_processglutamate catabolic process
F0006542biological_processglutamine biosynthetic process
F0001504biological_processneurotransmitter uptake
F0050679biological_processpositive regulation of epithelial cell proliferation
F0032024biological_processpositive regulation of insulin secretion
F0051968biological_processpositive regulation of synaptic transmission, glutamatergic
F0051260biological_processprotein homooligomerization
F0009749biological_processresponse to glucose
G0043679cellular_componentaxon terminus
G0005737cellular_componentcytoplasm
G0005829cellular_componentcytosol
G0070062cellular_componentextracellular exosome
G0097386cellular_componentglial cell projection
G0005739cellular_componentmitochondrion
G0043209cellular_componentmyelin sheath
G0005634cellular_componentnucleus
G0043204cellular_componentperikaryon
G0043234cellular_componentprotein complex
G0005791cellular_componentrough endoplasmic reticulum
G0005524molecular_functionATP binding
G0016595molecular_functionglutamate binding
G0004351molecular_functionglutamate decarboxylase activity
G0004356molecular_functionglutamate-ammonia ligase activity
G0000287molecular_functionmagnesium ion binding
G0030145molecular_functionmanganese ion binding
G0019676biological_processammonia assimilation cycle
G0008283biological_processcell proliferation
G0008652biological_processcellular amino acid biosynthetic process
G0009267biological_processcellular response to starvation
G0006538biological_processglutamate catabolic process
G0006542biological_processglutamine biosynthetic process
G0001504biological_processneurotransmitter uptake
G0050679biological_processpositive regulation of epithelial cell proliferation
G0032024biological_processpositive regulation of insulin secretion
G0051968biological_processpositive regulation of synaptic transmission, glutamatergic
G0051260biological_processprotein homooligomerization
G0009749biological_processresponse to glucose
H0043679cellular_componentaxon terminus
H0005737cellular_componentcytoplasm
H0005829cellular_componentcytosol
H0070062cellular_componentextracellular exosome
H0097386cellular_componentglial cell projection
H0005739cellular_componentmitochondrion
H0043209cellular_componentmyelin sheath
H0005634cellular_componentnucleus
H0043204cellular_componentperikaryon
H0043234cellular_componentprotein complex
H0005791cellular_componentrough endoplasmic reticulum
H0005524molecular_functionATP binding
H0016595molecular_functionglutamate binding
H0004351molecular_functionglutamate decarboxylase activity
H0004356molecular_functionglutamate-ammonia ligase activity
H0000287molecular_functionmagnesium ion binding
H0030145molecular_functionmanganese ion binding
H0019676biological_processammonia assimilation cycle
H0008283biological_processcell proliferation
H0008652biological_processcellular amino acid biosynthetic process
H0009267biological_processcellular response to starvation
H0006538biological_processglutamate catabolic process
H0006542biological_processglutamine biosynthetic process
H0001504biological_processneurotransmitter uptake
H0050679biological_processpositive regulation of epithelial cell proliferation
H0032024biological_processpositive regulation of insulin secretion
H0051968biological_processpositive regulation of synaptic transmission, glutamatergic
H0051260biological_processprotein homooligomerization
H0009749biological_processresponse to glucose
I0043679cellular_componentaxon terminus
I0005737cellular_componentcytoplasm
I0005829cellular_componentcytosol
I0070062cellular_componentextracellular exosome
I0097386cellular_componentglial cell projection
I0005739cellular_componentmitochondrion
I0043209cellular_componentmyelin sheath
I0005634cellular_componentnucleus
I0043204cellular_componentperikaryon
I0043234cellular_componentprotein complex
I0005791cellular_componentrough endoplasmic reticulum
I0005524molecular_functionATP binding
I0016595molecular_functionglutamate binding
I0004351molecular_functionglutamate decarboxylase activity
I0004356molecular_functionglutamate-ammonia ligase activity
I0000287molecular_functionmagnesium ion binding
I0030145molecular_functionmanganese ion binding
I0019676biological_processammonia assimilation cycle
I0008283biological_processcell proliferation
I0008652biological_processcellular amino acid biosynthetic process
I0009267biological_processcellular response to starvation
I0006538biological_processglutamate catabolic process
I0006542biological_processglutamine biosynthetic process
I0001504biological_processneurotransmitter uptake
I0050679biological_processpositive regulation of epithelial cell proliferation
I0032024biological_processpositive regulation of insulin secretion
I0051968biological_processpositive regulation of synaptic transmission, glutamatergic
I0051260biological_processprotein homooligomerization
I0009749biological_processresponse to glucose
J0043679cellular_componentaxon terminus
J0005737cellular_componentcytoplasm
J0005829cellular_componentcytosol
J0070062cellular_componentextracellular exosome
J0097386cellular_componentglial cell projection
J0005739cellular_componentmitochondrion
J0043209cellular_componentmyelin sheath
J0005634cellular_componentnucleus
J0043204cellular_componentperikaryon
J0043234cellular_componentprotein complex
J0005791cellular_componentrough endoplasmic reticulum
J0005524molecular_functionATP binding
J0016595molecular_functionglutamate binding
J0004351molecular_functionglutamate decarboxylase activity
J0004356molecular_functionglutamate-ammonia ligase activity
J0000287molecular_functionmagnesium ion binding
J0030145molecular_functionmanganese ion binding
J0019676biological_processammonia assimilation cycle
J0008283biological_processcell proliferation
J0008652biological_processcellular amino acid biosynthetic process
J0009267biological_processcellular response to starvation
J0006538biological_processglutamate catabolic process
J0006542biological_processglutamine biosynthetic process
J0001504biological_processneurotransmitter uptake
J0050679biological_processpositive regulation of epithelial cell proliferation
J0032024biological_processpositive regulation of insulin secretion
J0051968biological_processpositive regulation of synaptic transmission, glutamatergic
J0051260biological_processprotein homooligomerization
J0009749biological_processresponse to glucose
?

Functional Information from PDB Data

site_idNumber of ResiduesDetails
AC16BINDING SITE FOR RESIDUE MN A 401
ChainResidue
AGLU136
AGLU196
AGLU203
AMN403
AP3S601
AHOH704

AC26BINDING SITE FOR RESIDUE MN A 402
ChainResidue
AGLU134
AHIS253
AGLU338
AARG340
AADP501
AP3S601

AC36BINDING SITE FOR RESIDUE MN A 403
ChainResidue
AGLU134
AGLU203
AMN401
AADP501
AP3S601
AHOH729

AC46BINDING SITE FOR RESIDUE MN B 401
ChainResidue
BGLU136
BGLU196
BGLU203
BMN403
BP3S601
BHOH744

AC57BINDING SITE FOR RESIDUE MN B 402
ChainResidue
BGLU134
BHIS253
BGLU338
BARG340
BMN403
BADP501
BP3S601

AC67BINDING SITE FOR RESIDUE MN B 403
ChainResidue
BGLU134
BGLU203
BMN401
BMN402
BADP501
BP3S601
BHOH741

AC76BINDING SITE FOR RESIDUE MN C 401
ChainResidue
CGLU136
CGLU196
CGLU203
CMN403
CP3S601
CHOH740

AC86BINDING SITE FOR RESIDUE MN C 402
ChainResidue
CGLU134
CHIS253
CGLU338
CARG340
CADP501
CP3S601

AC96BINDING SITE FOR RESIDUE MN C 403
ChainResidue
CGLU134
CGLU203
CMN401
CADP501
CP3S601
CHOH738

BC15BINDING SITE FOR RESIDUE MN D 401
ChainResidue
DGLU136
DGLU196
DGLU203
DMN403
DP3S601

BC25BINDING SITE FOR RESIDUE MN D 402
ChainResidue
DGLU134
DHIS253
DGLU338
DADP501
DP3S601

BC36BINDING SITE FOR RESIDUE MN D 403
ChainResidue
DGLU134
DGLU203
DMN401
DADP501
DP3S601
DHOH747

BC45BINDING SITE FOR RESIDUE MN E 401
ChainResidue
EGLU136
EGLU196
EGLU203
EP3S601
EHOH629

BC56BINDING SITE FOR RESIDUE MN E 402
ChainResidue
EGLU134
EHIS253
EGLU338
EARG340
EADP501
EP3S601

BC65BINDING SITE FOR RESIDUE MN E 403
ChainResidue
EGLU134
EGLU203
EADP501
EP3S601
EHOH627

BC75BINDING SITE FOR RESIDUE MN F 401
ChainResidue
FGLU136
FGLU196
FGLU203
FMN403
FP3S601

BC86BINDING SITE FOR RESIDUE MN F 402
ChainResidue
FGLU134
FHIS253
FGLU338
FARG340
FADP501
FP3S601

BC96BINDING SITE FOR RESIDUE MN F 403
ChainResidue
FGLU134
FGLU203
FMN401
FADP501
FP3S601
FHOH717

CC15BINDING SITE FOR RESIDUE MN G 401
ChainResidue
GGLU136
GGLU196
GGLU203
GMN403
GP3S601

CC25BINDING SITE FOR RESIDUE MN G 402
ChainResidue
GGLU134
GHIS253
GGLU338
GADP501
GP3S601

CC35BINDING SITE FOR RESIDUE MN G 403
ChainResidue
GGLU134
GGLU203
GMN401
GADP501
GP3S601

CC46BINDING SITE FOR RESIDUE MN H 401
ChainResidue
HGLU136
HGLU196
HGLU203
HMN403
HP3S601
HHOH609

CC56BINDING SITE FOR RESIDUE MN H 402
ChainResidue
HGLU134
HHIS253
HGLU338
HMN403
HADP501
HP3S601

CC67BINDING SITE FOR RESIDUE MN H 403
ChainResidue
HGLU134
HGLU203
HMN401
HMN402
HADP501
HP3S601
HHOH608

CC75BINDING SITE FOR RESIDUE MN I 401
ChainResidue
IGLU136
IGLU196
IGLU203
IMN403
IP3S601

CC86BINDING SITE FOR RESIDUE MN I 402
ChainResidue
IGLU134
IHIS253
IGLU338
IARG340
IADP501
IP3S601

CC96BINDING SITE FOR RESIDUE MN I 403
ChainResidue
IGLU134
IGLU203
IMN401
IADP501
IP3S601
IHOH718

DC16BINDING SITE FOR RESIDUE MN J 401
ChainResidue
JGLU136
JGLU196
JGLU203
JMN403
JP3S601
JHOH718

DC25BINDING SITE FOR RESIDUE MN J 402
ChainResidue
JGLU134
JHIS253
JGLU338
JADP501
JP3S601

DC36BINDING SITE FOR RESIDUE MN J 403
ChainResidue
JGLU134
JGLU203
JMN401
JADP501
JP3S601
JHOH717

DC43BINDING SITE FOR RESIDUE CL B 701
ChainResidue
BMET29
BTHR44
CTHR193

DC54BINDING SITE FOR RESIDUE CL C 702
ChainResidue
CMET29
CTHR44
DTHR193
DHOH731

DC63BINDING SITE FOR RESIDUE CL A 703
ChainResidue
ATHR193
EMET29
ETHR44

DC72BINDING SITE FOR RESIDUE CL D 704
ChainResidue
DTHR44
ETHR193

DC83BINDING SITE FOR RESIDUE CL B 705
ChainResidue
AMET29
ATHR44
BTHR193

DC92BINDING SITE FOR RESIDUE CL F 706
ChainResidue
FTHR193
JTHR44

EC12BINDING SITE FOR RESIDUE CL G 707
ChainResidue
FTHR44
GTHR193

EC24BINDING SITE FOR RESIDUE CL G 708
ChainResidue
GMET29
GLYS43
GTHR44
HTHR193

EC32BINDING SITE FOR RESIDUE CL I 709
ChainResidue
HTHR44
ITHR193

EC42BINDING SITE FOR RESIDUE CL J 710
ChainResidue
ITHR44
JTHR193

EC520BINDING SITE FOR RESIDUE ADP A 501
ChainResidue
ATRP130
AGLY132
AGLU134
AGLU203
AGLN205
AGLY207
APRO208
AASN255
ASER257
AARG262
AARG319
AARG324
ATYR336
AGLU338
AMN402
AMN403
AP3S601
AHOH729
AHOH730
AHOH731

EC620BINDING SITE FOR RESIDUE P3S A 601
ChainResidue
AGLU134
AGLU136
AGLU196
AGLU203
AGLY249
AHIS253
AARG299
AGLU305
ATHR306
AARG319
AGLU338
AARG340
AMN401
AMN402
AMN403
AADP501
AHOH704
AHOH729
AHOH733
EASP63

EC719BINDING SITE FOR RESIDUE ADP B 501
ChainResidue
AHOH732
BTRP130
BGLY132
BGLU134
BGLU203
BGLN205
BILE206
BGLY207
BPRO208
BASN255
BSER257
BARG319
BARG324
BTYR336
BGLU338
BMN402
BMN403
BP3S601
BHOH742

EC820BINDING SITE FOR RESIDUE P3S B 601
ChainResidue
AASP63
BGLU134
BGLU136
BTYR162
BGLU196
BGLU203
BGLY249
BHIS253
BARG299
BGLU305
BTHR306
BARG319
BGLU338
BARG340
BMN401
BMN402
BMN403
BADP501
BHOH718
BHOH744

EC919BINDING SITE FOR RESIDUE ADP C 501
ChainResidue
CTRP130
CGLY132
CGLU134
CGLU203
CGLN205
CGLY207
CPRO208
CASN255
CSER257
CARG324
CTYR336
CGLU338
CMN402
CMN403
CP3S601
CHOH709
CHOH736
CHOH738
CHOH739

FC121BINDING SITE FOR RESIDUE P3S C 601
ChainResidue
BASP63
CGLU134
CGLU136
CTYR162
CGLU196
CGLU203
CGLY249
CHIS253
CARG299
CGLU305
CTHR306
CARG319
CGLU338
CARG340
CMN401
CMN402
CMN403
CADP501
CHOH704
CHOH730
CHOH740

FC218BINDING SITE FOR RESIDUE ADP D 501
ChainResidue
CHOH707
DTRP130
DGLY132
DGLU134
DGLU203
DGLN205
DGLY207
DPRO208
DASN255
DSER257
DARG319
DARG324
DTYR336
DGLU338
DMN402
DMN403
DP3S601
DHOH747

FC318BINDING SITE FOR RESIDUE P3S D 601
ChainResidue
CASP63
DGLU134
DGLU136
DGLU196
DGLU203
DGLY249
DHIS253
DARG299
DGLU305
DTHR306
DARG319
DGLU338
DARG340
DMN401
DMN402
DMN403
DADP501
DHOH711

FC420BINDING SITE FOR RESIDUE ADP E 501
ChainResidue
DHOH749
ETRP130
EGLY132
EGLU134
EGLU203
EGLN205
EGLY207
EPRO208
EASN255
ESER257
EARG319
EARG324
ETYR336
EGLU338
EMN402
EMN403
EP3S601
EHOH624
EHOH627
EHOH628

FC518BINDING SITE FOR RESIDUE P3S E 601
ChainResidue
DASP63
EGLU134
EGLU136
EGLU196
EGLU203
EGLY249
EHIS253
EARG299
EGLU305
ETHR306
EARG319
EGLU338
EARG340
EMN401
EMN402
EMN403
EADP501
EHOH629

FC620BINDING SITE FOR RESIDUE ADP F 501
ChainResidue
FTRP130
FGLY132
FGLU134
FALA191
FGLU203
FGLN205
FILE206
FGLY207
FPRO208
FASN255
FSER257
FARG319
FARG324
FTYR336
FGLU338
FMN402
FMN403
FP3S601
FHOH717
FHOH718

FC718BINDING SITE FOR RESIDUE P3S F 601
ChainResidue
FGLU134
FGLU136
FGLU196
FGLU203
FGLY249
FHIS253
FARG299
FGLU305
FTHR306
FARG319
FARG340
FMN401
FMN402
FMN403
FADP501
FHOH712
FHOH717
JASP63

FC818BINDING SITE FOR RESIDUE ADP G 501
ChainResidue
GTRP130
GGLY132
GGLU134
GALA191
GGLU203
GGLN205
GILE206
GGLY207
GPRO208
GASN255
GSER257
GARG319
GARG324
GTYR336
GGLU338
GMN402
GMN403
GP3S601

FC918BINDING SITE FOR RESIDUE P3S G 601
ChainResidue
FASP63
GGLU134
GGLU136
GGLU196
GGLU203
GASN248
GGLY249
GHIS253
GARG299
GGLU305
GTHR306
GARG319
GGLU338
GARG340
GMN401
GMN402
GMN403
GADP501

GC117BINDING SITE FOR RESIDUE ADP H 501
ChainResidue
HGLY132
HGLU134
HALA191
HGLU203
HGLN205
HGLY207
HPRO208
HASN255
HSER257
HARG319
HARG324
HTYR336
HGLU338
HMN402
HMN403
HP3S601
HHOH608

GC218BINDING SITE FOR RESIDUE P3S H 601
ChainResidue
GASP63
HGLU134
HGLU136
HTYR162
HGLU196
HGLU203
HGLY249
HHIS253
HARG299
HGLU305
HARG319
HGLU338
HARG340
HMN401
HMN402
HMN403
HADP501
HHOH608

GC319BINDING SITE FOR RESIDUE ADP I 501
ChainResidue
ITRP130
IGLY132
IGLU134
IGLU203
IGLN205
IILE206
IGLY207
IPRO208
IASN255
ISER257
IARG319
IARG324
ITYR336
IGLU338
IMN402
IMN403
IP3S601
IHOH718
IHOH719

GC419BINDING SITE FOR RESIDUE P3S I 601
ChainResidue
HASP63
IGLU134
IGLU136
IGLU196
IGLU203
IASN248
IGLY249
IGLY251
IHIS253
IARG299
IGLU305
IARG319
IARG324
IGLU338
IARG340
IMN401
IMN402
IMN403
IADP501

GC518BINDING SITE FOR RESIDUE ADP J 501
ChainResidue
JTRP130
JGLY132
JGLU134
JALA191
JGLU203
JGLN205
JGLY207
JPRO208
JASN255
JSER257
JARG319
JARG324
JTYR336
JGLU338
JMN402
JMN403
JP3S601
JHOH717

GC620BINDING SITE FOR RESIDUE P3S J 601
ChainResidue
IASP63
JGLU134
JGLU136
JTYR162
JGLU196
JGLU203
JGLY249
JHIS253
JARG299
JGLU305
JTHR306
JARG319
JGLU338
JARG340
JMN401
JMN402
JMN403
JADP501
JHOH714
JHOH718

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Functional Information from PDB atom coordinates for the "HETATM" binding sites

site_idNumber of ResiduesDetails
ADP_2qc8_B_50126ADENOSINE-5'-DIPHOSPHATE binding site
ChainResidueligand
ALYS43ADP: ADENOSINE-5'-DIPHOSPHATE
ATRP60-ASN61ADP: ADENOSINE-5'-DIPHOSPHATE
BTRP130-GLU134ADP: ADENOSINE-5'-DIPHOSPHATE
BALA191ADP: ADENOSINE-5'-DIPHOSPHATE
BASN194ADP: ADENOSINE-5'-DIPHOSPHATE
BGLU203ADP: ADENOSINE-5'-DIPHOSPHATE
BGLN205-PRO208ADP: ADENOSINE-5'-DIPHOSPHATE
BHIS253ADP: ADENOSINE-5'-DIPHOSPHATE
BASN255-SER257ADP: ADENOSINE-5'-DIPHOSPHATE
BARG262ADP: ADENOSINE-5'-DIPHOSPHATE
BARG319ADP: ADENOSINE-5'-DIPHOSPHATE
BARG324ADP: ADENOSINE-5'-DIPHOSPHATE
BGLY335-TYR336ADP: ADENOSINE-5'-DIPHOSPHATE
BGLU338ADP: ADENOSINE-5'-DIPHOSPHATE
BARG340ADP: ADENOSINE-5'-DIPHOSPHATE

P3S_2qc8_B_60123L-METHIONINE-S-SULFOXIMINE PHOSPHATE binding site
ChainResidueligand
AASP63P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
ASER66P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
BGLU134P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
BGLU136P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
BTYR162P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
BASN194P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
BGLU196-VAL197P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
BGLN201P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
BGLU203P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
BASN248-GLY251P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
BHIS253P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
BARG299P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
BHIS304-THR306P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
BARG319P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
BARG324P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
BGLU338P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
BARG340P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE

ADP_2qc8_A_50126ADENOSINE-5'-DIPHOSPHATE binding site
ChainResidueligand
ATRP130-GLU134ADP: ADENOSINE-5'-DIPHOSPHATE
AALA191ADP: ADENOSINE-5'-DIPHOSPHATE
AASN194ADP: ADENOSINE-5'-DIPHOSPHATE
AGLU203ADP: ADENOSINE-5'-DIPHOSPHATE
AGLN205-PRO208ADP: ADENOSINE-5'-DIPHOSPHATE
AHIS253ADP: ADENOSINE-5'-DIPHOSPHATE
AASN255-SER257ADP: ADENOSINE-5'-DIPHOSPHATE
AARG262ADP: ADENOSINE-5'-DIPHOSPHATE
AARG319ADP: ADENOSINE-5'-DIPHOSPHATE
AARG324ADP: ADENOSINE-5'-DIPHOSPHATE
AGLY335-TYR336ADP: ADENOSINE-5'-DIPHOSPHATE
AGLU338ADP: ADENOSINE-5'-DIPHOSPHATE
AARG340ADP: ADENOSINE-5'-DIPHOSPHATE
ELYS43ADP: ADENOSINE-5'-DIPHOSPHATE
ETRP60-ASN61ADP: ADENOSINE-5'-DIPHOSPHATE

P3S_2qc8_A_60123L-METHIONINE-S-SULFOXIMINE PHOSPHATE binding site
ChainResidueligand
AGLU134P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
AGLU136P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
ATYR162P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
AASN194P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
AGLU196-VAL197P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
AGLN201P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
AGLU203P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
AASN248-GLY251P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
AHIS253P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
AARG299P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
AHIS304-THR306P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
AARG319P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
AARG324P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
AGLU338P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
AARG340P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
EASP63P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
ESER66P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE

ADP_2qc8_C_50126ADENOSINE-5'-DIPHOSPHATE binding site
ChainResidueligand
BLYS43ADP: ADENOSINE-5'-DIPHOSPHATE
BTRP60-ASN61ADP: ADENOSINE-5'-DIPHOSPHATE
CTRP130-GLU134ADP: ADENOSINE-5'-DIPHOSPHATE
CALA191ADP: ADENOSINE-5'-DIPHOSPHATE
CASN194ADP: ADENOSINE-5'-DIPHOSPHATE
CGLU203ADP: ADENOSINE-5'-DIPHOSPHATE
CGLN205-PRO208ADP: ADENOSINE-5'-DIPHOSPHATE
CHIS253ADP: ADENOSINE-5'-DIPHOSPHATE
CASN255-SER257ADP: ADENOSINE-5'-DIPHOSPHATE
CARG262ADP: ADENOSINE-5'-DIPHOSPHATE
CARG319ADP: ADENOSINE-5'-DIPHOSPHATE
CARG324ADP: ADENOSINE-5'-DIPHOSPHATE
CGLY335-TYR336ADP: ADENOSINE-5'-DIPHOSPHATE
CGLU338ADP: ADENOSINE-5'-DIPHOSPHATE
CARG340ADP: ADENOSINE-5'-DIPHOSPHATE

P3S_2qc8_C_60123L-METHIONINE-S-SULFOXIMINE PHOSPHATE binding site
ChainResidueligand
BASP63P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
BSER66P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
CGLU134P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
CGLU136P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
CTYR162P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
CASN194P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
CGLU196-VAL197P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
CGLN201P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
CGLU203P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
CASN248-GLY251P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
CHIS253P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
CARG299P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
CHIS304-THR306P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
CARG319P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
CARG324P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
CGLU338P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
CARG340P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE

ADP_2qc8_D_50126ADENOSINE-5'-DIPHOSPHATE binding site
ChainResidueligand
CLYS43ADP: ADENOSINE-5'-DIPHOSPHATE
CTRP60-ASN61ADP: ADENOSINE-5'-DIPHOSPHATE
DTRP130-GLU134ADP: ADENOSINE-5'-DIPHOSPHATE
DALA191ADP: ADENOSINE-5'-DIPHOSPHATE
DASN194ADP: ADENOSINE-5'-DIPHOSPHATE
DGLU203ADP: ADENOSINE-5'-DIPHOSPHATE
DGLN205-PRO208ADP: ADENOSINE-5'-DIPHOSPHATE
DHIS253ADP: ADENOSINE-5'-DIPHOSPHATE
DASN255-SER257ADP: ADENOSINE-5'-DIPHOSPHATE
DARG262ADP: ADENOSINE-5'-DIPHOSPHATE
DARG319ADP: ADENOSINE-5'-DIPHOSPHATE
DARG324ADP: ADENOSINE-5'-DIPHOSPHATE
DGLY335-TYR336ADP: ADENOSINE-5'-DIPHOSPHATE
DGLU338ADP: ADENOSINE-5'-DIPHOSPHATE
DARG340ADP: ADENOSINE-5'-DIPHOSPHATE

P3S_2qc8_D_60123L-METHIONINE-S-SULFOXIMINE PHOSPHATE binding site
ChainResidueligand
CASP63P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
CSER66P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
DGLU134P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
DGLU136P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
DTYR162P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
DASN194P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
DGLU196-VAL197P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
DGLN201P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
DGLU203P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
DASN248-GLY251P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
DHIS253P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
DARG299P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
DHIS304-THR306P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
DARG319P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
DARG324P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
DGLU338P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
DARG340P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE

ADP_2qc8_E_50125ADENOSINE-5'-DIPHOSPHATE binding site
ChainResidueligand
DLYS43ADP: ADENOSINE-5'-DIPHOSPHATE
DTRP60-ASN61ADP: ADENOSINE-5'-DIPHOSPHATE
ETRP130-GLU134ADP: ADENOSINE-5'-DIPHOSPHATE
EALA191ADP: ADENOSINE-5'-DIPHOSPHATE
EASN194ADP: ADENOSINE-5'-DIPHOSPHATE
EGLU203ADP: ADENOSINE-5'-DIPHOSPHATE
EGLN205-PRO208ADP: ADENOSINE-5'-DIPHOSPHATE
EHIS253ADP: ADENOSINE-5'-DIPHOSPHATE
EASN255-SER257ADP: ADENOSINE-5'-DIPHOSPHATE
EARG262ADP: ADENOSINE-5'-DIPHOSPHATE
EARG319ADP: ADENOSINE-5'-DIPHOSPHATE
EARG324ADP: ADENOSINE-5'-DIPHOSPHATE
EGLY335-TYR336ADP: ADENOSINE-5'-DIPHOSPHATE
EGLU338ADP: ADENOSINE-5'-DIPHOSPHATE

P3S_2qc8_E_60123L-METHIONINE-S-SULFOXIMINE PHOSPHATE binding site
ChainResidueligand
DASP63P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
DSER66P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
EGLU134P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
EGLU136P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
ETYR162P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
EASN194P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
EGLU196-VAL197P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
EGLN201P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
EGLU203P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
EASN248-GLY251P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
EHIS253P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
EARG299P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
EHIS304-THR306P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
EARG319P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
EARG324P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
EGLU338P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
EARG340P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE

ADP_2qc8_G_50124ADENOSINE-5'-DIPHOSPHATE binding site
ChainResidueligand
FLYS43ADP: ADENOSINE-5'-DIPHOSPHATE
FTRP60-ASN61ADP: ADENOSINE-5'-DIPHOSPHATE
GTRP130-GLU134ADP: ADENOSINE-5'-DIPHOSPHATE
GALA191ADP: ADENOSINE-5'-DIPHOSPHATE
GGLU203ADP: ADENOSINE-5'-DIPHOSPHATE
GGLN205-PRO208ADP: ADENOSINE-5'-DIPHOSPHATE
GHIS253ADP: ADENOSINE-5'-DIPHOSPHATE
GASN255-SER257ADP: ADENOSINE-5'-DIPHOSPHATE
GARG262ADP: ADENOSINE-5'-DIPHOSPHATE
GARG319ADP: ADENOSINE-5'-DIPHOSPHATE
GARG324ADP: ADENOSINE-5'-DIPHOSPHATE
GGLY335-TYR336ADP: ADENOSINE-5'-DIPHOSPHATE
GGLU338ADP: ADENOSINE-5'-DIPHOSPHATE

P3S_2qc8_G_60123L-METHIONINE-S-SULFOXIMINE PHOSPHATE binding site
ChainResidueligand
FASP63P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
FSER66P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
GGLU134P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
GGLU136P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
GTYR162P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
GASN194P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
GGLU196-VAL197P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
GGLN201P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
GGLU203P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
GASN248-GLY251P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
GHIS253P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
GARG299P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
GHIS304-THR306P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
GARG319P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
GARG324P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
GGLU338P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
GARG340P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE

ADP_2qc8_F_50126ADENOSINE-5'-DIPHOSPHATE binding site
ChainResidueligand
FTRP130-GLU134ADP: ADENOSINE-5'-DIPHOSPHATE
FALA191ADP: ADENOSINE-5'-DIPHOSPHATE
FASN194ADP: ADENOSINE-5'-DIPHOSPHATE
FGLU203ADP: ADENOSINE-5'-DIPHOSPHATE
FGLN205-PRO208ADP: ADENOSINE-5'-DIPHOSPHATE
FHIS253ADP: ADENOSINE-5'-DIPHOSPHATE
FASN255-SER257ADP: ADENOSINE-5'-DIPHOSPHATE
FARG262ADP: ADENOSINE-5'-DIPHOSPHATE
FARG319ADP: ADENOSINE-5'-DIPHOSPHATE
FARG324ADP: ADENOSINE-5'-DIPHOSPHATE
FGLY335-TYR336ADP: ADENOSINE-5'-DIPHOSPHATE
FGLU338ADP: ADENOSINE-5'-DIPHOSPHATE
FARG340ADP: ADENOSINE-5'-DIPHOSPHATE
JLYS43ADP: ADENOSINE-5'-DIPHOSPHATE
JTRP60-ASN61ADP: ADENOSINE-5'-DIPHOSPHATE

P3S_2qc8_F_60122L-METHIONINE-S-SULFOXIMINE PHOSPHATE binding site
ChainResidueligand
FGLU134P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
FGLU136P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
FTYR162P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
FGLU196-VAL197P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
FGLN201P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
FGLU203P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
FASN248-GLY251P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
FHIS253P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
FARG299P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
FHIS304-THR306P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
FARG319P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
FARG324P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
FGLU338P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
FARG340P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
JASP63P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
JSER66P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE

ADP_2qc8_H_50126ADENOSINE-5'-DIPHOSPHATE binding site
ChainResidueligand
GLYS43ADP: ADENOSINE-5'-DIPHOSPHATE
GTRP60-ASN61ADP: ADENOSINE-5'-DIPHOSPHATE
HTRP130-GLU134ADP: ADENOSINE-5'-DIPHOSPHATE
HALA191ADP: ADENOSINE-5'-DIPHOSPHATE
HASN194ADP: ADENOSINE-5'-DIPHOSPHATE
HGLU203ADP: ADENOSINE-5'-DIPHOSPHATE
HGLN205-PRO208ADP: ADENOSINE-5'-DIPHOSPHATE
HHIS253ADP: ADENOSINE-5'-DIPHOSPHATE
HASN255-SER257ADP: ADENOSINE-5'-DIPHOSPHATE
HARG262ADP: ADENOSINE-5'-DIPHOSPHATE
HARG319ADP: ADENOSINE-5'-DIPHOSPHATE
HARG324ADP: ADENOSINE-5'-DIPHOSPHATE
HGLY335-TYR336ADP: ADENOSINE-5'-DIPHOSPHATE
HGLU338ADP: ADENOSINE-5'-DIPHOSPHATE
HARG340ADP: ADENOSINE-5'-DIPHOSPHATE

P3S_2qc8_H_60123L-METHIONINE-S-SULFOXIMINE PHOSPHATE binding site
ChainResidueligand
GASP63P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
GSER66P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
HGLU134P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
HGLU136P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
HTYR162P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
HASN194P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
HGLU196-VAL197P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
HGLN201P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
HGLU203P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
HASN248-GLY251P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
HHIS253P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
HARG299P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
HHIS304-THR306P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
HARG319P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
HARG324P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
HGLU338P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
HARG340P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE

ADP_2qc8_I_50126ADENOSINE-5'-DIPHOSPHATE binding site
ChainResidueligand
HLYS43ADP: ADENOSINE-5'-DIPHOSPHATE
HTRP60-ASN61ADP: ADENOSINE-5'-DIPHOSPHATE
ITRP130-GLU134ADP: ADENOSINE-5'-DIPHOSPHATE
IALA191ADP: ADENOSINE-5'-DIPHOSPHATE
IASN194ADP: ADENOSINE-5'-DIPHOSPHATE
IGLU203ADP: ADENOSINE-5'-DIPHOSPHATE
IGLN205-PRO208ADP: ADENOSINE-5'-DIPHOSPHATE
IHIS253ADP: ADENOSINE-5'-DIPHOSPHATE
IASN255-SER257ADP: ADENOSINE-5'-DIPHOSPHATE
IARG262ADP: ADENOSINE-5'-DIPHOSPHATE
IARG319ADP: ADENOSINE-5'-DIPHOSPHATE
IARG324ADP: ADENOSINE-5'-DIPHOSPHATE
IGLY335-TYR336ADP: ADENOSINE-5'-DIPHOSPHATE
IGLU338ADP: ADENOSINE-5'-DIPHOSPHATE
IARG340ADP: ADENOSINE-5'-DIPHOSPHATE

P3S_2qc8_I_60122L-METHIONINE-S-SULFOXIMINE PHOSPHATE binding site
ChainResidueligand
HASP63P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
HSER66P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
IGLU134P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
IGLU136P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
ITYR162P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
IGLU196-VAL197P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
IGLN201P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
IGLU203P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
IASN248-GLY251P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
IHIS253P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
IARG299P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
IHIS304-THR306P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
IARG319P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
IARG324P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
IGLU338P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
IARG340P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE

ADP_2qc8_J_50125ADENOSINE-5'-DIPHOSPHATE binding site
ChainResidueligand
ILYS43ADP: ADENOSINE-5'-DIPHOSPHATE
ITRP60-ASN61ADP: ADENOSINE-5'-DIPHOSPHATE
JTRP130-GLU134ADP: ADENOSINE-5'-DIPHOSPHATE
JALA191ADP: ADENOSINE-5'-DIPHOSPHATE
JASN194ADP: ADENOSINE-5'-DIPHOSPHATE
JGLU203ADP: ADENOSINE-5'-DIPHOSPHATE
JGLN205-PRO208ADP: ADENOSINE-5'-DIPHOSPHATE
JHIS253ADP: ADENOSINE-5'-DIPHOSPHATE
JASN255-SER257ADP: ADENOSINE-5'-DIPHOSPHATE
JARG262ADP: ADENOSINE-5'-DIPHOSPHATE
JARG319ADP: ADENOSINE-5'-DIPHOSPHATE
JARG324ADP: ADENOSINE-5'-DIPHOSPHATE
JGLY335-TYR336ADP: ADENOSINE-5'-DIPHOSPHATE
JGLU338ADP: ADENOSINE-5'-DIPHOSPHATE

P3S_2qc8_J_60123L-METHIONINE-S-SULFOXIMINE PHOSPHATE binding site
ChainResidueligand
IASP63P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
ISER66P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
JGLU134P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
JGLU136P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
JTYR162P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
JASN194P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
JGLU196-VAL197P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
JGLN201P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
JGLU203P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
JASN248-GLY251P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
JHIS253P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
JARG299P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
JHIS304-THR306P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
JARG319P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
JARG324P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
JGLU338P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE
JARG340P3S: L-METHIONINE-S-SULFOXIMINE PHOSPHATE

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Functional Information from PROSITE/UniProt

site_idNumber of ResiduesDetails
PS0018010Glutamine synthetase signature 1. [FYWL]-D-G-S-S-x(6,8)-[DENQSTAK]-[SA]-[DE]-x(2)-[LIVMFY]
ChainResidueDetails
ANA*
BNA*
CNA*
DNA*
ENA*
FNA*
GNA*
HNA*
INA*
JNA*

PS0018110Glutamine synthetase putative ATP-binding region signature. K-P-[LIVMFYA]-x(3,5)-[NPAT]-[GA]-[GSTAN]-[GA]-x-H-x(3)-S
ChainResidueDetails
ANA*
BNA*
CNA*
DNA*
ENA*
FNA*
GNA*
HNA*
INA*
JNA*

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Functional Information from SwissProt/UniProt

site_idNumber of ResiduesDetails
?

Catalytic Information from CSA

site_idNumber of ResiduesDetails
CSA13Annotated By Reference To The Literature 1hto
ChainResidueDetails
AARG319
AGLU305
AASP63

CSA23Annotated By Reference To The Literature 1hto
ChainResidueDetails
BARG319
BGLU305
BASP63

CSA33Annotated By Reference To The Literature 1hto
ChainResidueDetails
CARG319
CGLU305
CASP63

CSA43Annotated By Reference To The Literature 1hto
ChainResidueDetails
DARG319
DGLU305
DASP63

CSA53Annotated By Reference To The Literature 1hto
ChainResidueDetails
EARG319
EGLU305
EASP63

CSA63Annotated By Reference To The Literature 1hto
ChainResidueDetails
FARG319
FGLU305
FASP63

CSA73Annotated By Reference To The Literature 1hto
ChainResidueDetails
GARG319
GGLU305
GASP63

CSA83Annotated By Reference To The Literature 1hto
ChainResidueDetails
HARG319
HGLU305
HASP63

CSA93Annotated By Reference To The Literature 1hto
ChainResidueDetails
IARG319
IGLU305
IASP63

CSA103Annotated By Reference To The Literature 1hto
ChainResidueDetails
JARG319
JGLU305
JASP63

> Sequence Neighbor

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