5ES4: Integrin alpha-X

Re-refinement of integrin ALPHAXBETA2 ectodomain in the closed/bent conformation. Determined by X-ray diffraction at 3.3 Å resolution. Released 2 Mar 2016.

Method
X-ray diffraction
Resolution
3.3 Å
Organism
Homo sapiens
Chains
8
Atoms
51,071
Mol. weight
847.07 kDa
Ligands
NAG, MG, CA
Released
2 Mar 2016

Explore 5ES4 in 3D Show helices and sheets RCSB PDB PDBe

Secondary structure: helices and β-sheets

5ES4 contains 191 α-helices and 535 β-strands across 8 chains. Residue ranges use author residue numbering, as in the PDB file, from PDBe. To see them in 3D, choose the Cartoon representation with Secondary structure coloring: helices, sheets and coils get different colors.

Chain A: 30 helices, 92 β-strands

ElementResiduesLengthSheet
β-strand3-12101
β-strand21-2552
β-strand29-40122
β-strand43-4422
β-strand4513
β-strand46-5162
β-strand57-5932
β-strand6914
β-strand7313
β-strand76-8054
β-strand85-97134
β-strand100-110114
β-strand117-11934
α-helix123-1264
β-strand131-13885
α-helix145-15915
β-strand167-17485
β-strand178-18255
α-helix184-1896
α-helix194-1985
β-strand20716
α-helix209-2157
α-helix216-2205
α-helix223-2253
β-strand232-23985
β-strand24416
α-helix250-26011
β-strand262-26985
α-helix271-2733
α-helix276-28510
α-helix2871
α-helix290-2934
β-strand294-29745
α-helix303-31513
β-strand33917
β-strand347-35047
α-helix353-3564
β-strand35818
β-strand359-36247
β-strand370-37237
α-helix379-3813
β-strand38618
β-strand389-39469
β-strand399-40579
α-helix408-4103
β-strand412110
β-strand413-42089
β-strand423-43199
β-strand439110
β-strand443-446411
β-strand456-460511
β-strand465112
β-strand469-471313
β-strand473-477511
α-helix478-4792
β-strand489-491311
β-strand497-502613
β-strand506-511614
β-strand518-524714
α-helix527-5304
β-strand532115
β-strand533-538614
β-strand539-540216
β-strand544-545216
β-strand551-554414
α-helix555-5584
β-strand565115
β-strand568-57361
β-strand582-58761
β-strand590-59671
α-helix597-5982
β-strand599-600217
β-strand602-609818
β-strand613119
α-helix615-6184
β-strand621120
β-strand623120
α-helix6281
β-strand629-6391118
β-strand654-662921
β-strand672-673218
β-strand680-687821
β-strand692-700918
α-helix7101
β-strand711-719921
β-strand733-734217
β-strand741-746621
α-helix7471
β-strand748119
α-helix7491
β-strand762-767622
β-strand774-776323
β-strand779123
β-strand781-7901022
α-helix7941
β-strand795-796224
β-strand799-805725
β-strand808-811422
β-strand827-834825
β-strand839-846825
β-strand849126
β-strand850-851224
β-strand856-8651022
α-helix8661
β-strand874-882925
β-strand895-900625
β-strand901-905523
β-strand907-911527
β-strand929-9401227
β-strand946-9581328
β-strand961-962228
β-strand968-970327
β-strand980-984528
α-helix991-9966
β-strand1000-1001228
β-strand1007-10181228
β-strand1023-10331127
α-helix1037-10404
β-strand1046-1054928
β-strand1060-1062323
α-helix1068-10703
β-strand1071-1077728
Chain B: 28 helices, 56 β-strands
ElementResiduesLengthSheet
α-helix11-155
β-strand22-24329
β-strand31130
β-strand34130
α-helix36-394
β-strand40-41229
α-helix43-486
α-helix53-553
β-strand56-57229
β-strand62-65431
β-strand76-77232
β-strand80-85631
β-strand91-97732
β-strand105-112833
α-helix115-1173
α-helix118-1247
α-helix128-1358
β-strand143-149733
α-helix162-1665
β-strand176134
β-strand182-189833
α-helix192-1998
α-helix2031
β-strand204134
β-strand212135
α-helix214-2218
β-strand234-241833
β-strand245135
α-helix251-2544
α-helix258-2603
β-strand267133
β-strand270133
α-helix273-2764
α-helix278-2814
α-helix282-29110
β-strand294-300733
α-helix305-3095
β-strand319-322433
α-helix330-34112
β-strand345-349531
β-strand356-360532
β-strand363132
β-strand364136
β-strand368136
β-strand373132
β-strand376-378331
β-strand387-395932
α-helix399-4013
β-strand402-409831
β-strand414-421831
α-helix436-4394
β-strand441-443337
β-strand448-450337
β-strand454-455238
β-strand461-462238
α-helix471-4733
β-strand481126
α-helix4821
α-helix483-4853
β-strand488139
β-strand491140
β-strand494140
β-strand497139
α-helix498-4992
β-strand507-508241
β-strand514-515241
β-strand521-522242
β-strand525-526242
β-strand533-536443
β-strand539-542443
α-helix5431
β-strand546-547244
β-strand553-554244
β-strand561145
β-strand567145
β-strand573-574246
β-strand579-580246
α-helix600-6034
α-helix604-6107
α-helix621-6244
β-strand628-630347
β-strand638-643647
β-strand649-656847
β-strand663-667547
Chain C: 14 helices, 81 β-strands
ElementResiduesLengthSheet
β-strand9-12448
β-strand21-25549
β-strand29-33549
β-strand40150
β-strand43150
β-strand45151
β-strand47-51549
β-strand57-59349
β-strand69152
β-strand73151
β-strand76-80552
β-strand85-961252
β-strand101-1111152
β-strand114-119652
β-strand338-340353
β-strand347-350453
α-helix353-3564
β-strand358154
β-strand359-362453
β-strand370-372353
β-strand386154
β-strand389-393555
β-strand400-405655
α-helix408-4103
β-strand412156
β-strand413-420855
β-strand423-431955
β-strand439156
β-strand442-446557
β-strand456-4661157
β-strand469-477957
β-strand489-491357
β-strand497-502657
β-strand505-510658
β-strand519-524658
α-helix527-5304
β-strand532159
β-strand533-538658
β-strand539-540260
β-strand544-545260
β-strand552-554358
α-helix555-5584
β-strand565159
β-strand568-573648
β-strand582-586548
β-strand590-595648
α-helix596-5983
β-strand599-600261
β-strand603-609762
β-strand613163
α-helix615-6173
α-helix626-6283
β-strand629-6381062
β-strand654-662964
β-strand672-673262
β-strand680-687864
β-strand692-700962
β-strand711-719964
β-strand733-734261
β-strand741-746664
α-helix7471
β-strand748163
α-helix7491
β-strand762-767665
β-strand774-776366
β-strand779166
β-strand781-7901065
β-strand795-796267
β-strand799-805725
β-strand808-811465
β-strand828-833625
β-strand839-845725
β-strand849168
β-strand850-851267
β-strand856-8651065
β-strand874-882925
β-strand895-900625
β-strand901-905566
β-strand907-911569
α-helix923-9253
β-strand929-9401269
β-strand946-9581370
β-strand961-962270
β-strand964-970769
β-strand979-984670
α-helix985-9884
α-helix991-9977
β-strand1000-1001270
β-strand1007-10181270
β-strand1023-10331169
α-helix1036-10405
β-strand1046-1054970
β-strand1060-1062366
α-helix1068-10703
β-strand1071-1077770
Chain D: 27 helices, 47 β-strands
ElementResiduesLengthSheet
α-helix11-155
β-strand22-24371
α-helix36-394
β-strand40-41271
α-helix43-497
α-helix53-553
β-strand56-57271
α-helix59-613
β-strand62-65472
β-strand76-77273
β-strand80-85672
β-strand91-97773
β-strand106-112774
α-helix115-1173
α-helix118-1247
α-helix128-1358
β-strand143-149774
α-helix162-1665
β-strand182-189874
α-helix192-1998
β-strand212175
α-helix214-2218
α-helix225-2284
β-strand235-240674
β-strand245175
α-helix251-2544
α-helix259-2602
α-helix272-2754
α-helix278-2814
α-helix282-29110
β-strand294-301874
α-helix305-31410
β-strand319-323574
α-helix330-34112
β-strand345176
β-strand347-349372
α-helix351-3533
β-strand356-363873
β-strand369-373573
β-strand378176
β-strand387-395973
β-strand402-408772
β-strand414-421872
β-strand442-444377
β-strand447-449377
β-strand454-455278
β-strand460-462378
β-strand481168
α-helix4821
α-helix483-4864
β-strand488-491479
β-strand494-497479
β-strand508180
β-strand514180
β-strand521-522281
β-strand525-526281
β-strand533-536482
β-strand539-542482
α-helix5431
β-strand546-547283
β-strand553-554283
β-strand561184
β-strand567184
β-strand574185
β-strand579185
α-helix597-5982
α-helix604-6107
α-helix621-6244
β-strand628-630386
α-helix6311
β-strand638-643686
β-strand649-656886
β-strand663-667586
β-strand672186
Chain E: 16 helices, 81 β-strands
ElementResiduesLengthSheet
β-strand3187
β-strand9-12488
β-strand21-25589
β-strand29-34689
β-strand40190
β-strand43190
β-strand45191
β-strand46-51689
β-strand56-59489
β-strand73191
β-strand76-81692
β-strand84-971492
β-strand100-1101192
α-helix115-1162
β-strand117-119392
α-helix123-1242
β-strand339-340293
β-strand347-350493
α-helix353-3564
β-strand359-362493
β-strand370-372393
α-helix379-3813
β-strand389-394694
β-strand399-405794
α-helix408-4103
β-strand413-420894
β-strand423-431994
β-strand442-446595
β-strand456-460595
β-strand465-466296
β-strand469-471396
β-strand473-477595
α-helix483-4853
β-strand489-491395
β-strand497-502696
β-strand505-510697
β-strand519-524697
α-helix527-5304
β-strand532198
β-strand533-538697
β-strand539-540299
β-strand544-545299
β-strand551-554497
α-helix555-5584
β-strand565198
β-strand568-573688
β-strand582-587688
β-strand590-595688
β-strand596187
β-strand599-6002100
β-strand602-609818
β-strand6131101
α-helix6281
β-strand629-6391118
β-strand654-6629102
β-strand672-673218
β-strand678118
β-strand680-6878102
β-strand692-700918
β-strand711-7188102
α-helix726-7283
β-strand733-7342100
β-strand742-7465102
α-helix7471
β-strand7481101
α-helix749-7502
β-strand762-7676103
β-strand774-7763104
β-strand7791104
β-strand781-79010103
β-strand7951105
β-strand799-8057106
β-strand808-8114103
β-strand827-8337106
β-strand839-8468106
β-strand8491107
β-strand8511105
β-strand856-86510103
β-strand874-8829106
β-strand895-9006106
β-strand901-9055104
β-strand907-9115108
β-strand929-94012108
β-strand946-95813109
β-strand961-9622109
β-strand964-9707108
β-strand980-9845109
α-helix985-9884
α-helix991-9944
β-strand1000-10012109
β-strand1007-101812109
β-strand1023-103311108
α-helix1035-10406
β-strand1046-10549109
β-strand1060-10623104
α-helix1068-10703
β-strand1071-10777109
Chain F: 28 helices, 46 β-strands
ElementResiduesLengthSheet
α-helix11-155
β-strand22-243110
α-helix36-394
β-strand40-412110
α-helix43-486
α-helix53-553
β-strand56-572110
β-strand62-654111
β-strand76-772112
β-strand80-856111
β-strand91-977112
β-strand105-1128113
α-helix115-1173
α-helix118-1247
α-helix125-1273
α-helix128-13811
β-strand143-1497113
α-helix162-1665
β-strand182-1898113
α-helix192-2009
β-strand2121114
α-helix214-2229
α-helix225-2284
β-strand234-2418113
β-strand2451114
α-helix251-2544
α-helix272-2754
α-helix278-2814
α-helix282-29110
β-strand294-3007113
α-helix302-3098
α-helix311-3144
β-strand319-3224113
α-helix330-34314
β-strand3451115
β-strand347-3493111
β-strand356-3638112
β-strand369-3735112
β-strand3781115
β-strand387-3959112
α-helix399-4013
β-strand402-4087111
β-strand414-4218111
β-strand441-4444116
β-strand447-4504116
α-helix4511
β-strand454-4552117
β-strand461-4622117
α-helix471-4744
β-strand4811107
α-helix483-4853
β-strand488-4914118
β-strand494-4974118
β-strand507-5082119
β-strand514-5152119
β-strand521-5222120
β-strand525-5262120
β-strand533-5364121
β-strand539-5424121
α-helix5431
β-strand546-5472122
β-strand553-5542122
β-strand5611123
β-strand5671123
β-strand572-5743124
β-strand579-5813124
α-helix597-5982
α-helix601-6033
α-helix604-6118
α-helix615-6173
β-strand628-6303125
β-strand640-6434125
β-strand649-6579125
β-strand662-67211125
Chain G: 19 helices, 83 β-strands
ElementResiduesLengthSheet
β-strand31126
β-strand9-124127
β-strand21-255128
β-strand29-335128
β-strand38-403129
β-strand43-442129
β-strand451130
β-strand47-504128
β-strand57-593128
α-helix60-612
β-strand691131
β-strand731130
β-strand76-805131
β-strand85-9612131
β-strand101-11010131
α-helix115-1162
β-strand117-1193131
α-helix123-1253
β-strand338-3403132
β-strand347-3493132
α-helix353-3564
β-strand360-3623132
β-strand370-3723132
α-helix379-3813
β-strand389-3957133
β-strand398-4058133
α-helix408-4103
β-strand4121134
β-strand413-4208133
β-strand423-4319133
β-strand4391134
β-strand443-4464135
β-strand456-4605135
β-strand4651136
β-strand469-4713137
β-strand473-4775135
α-helix478-4792
β-strand489-4913135
β-strand497-5026137
β-strand506-5105138
β-strand519-5235138
α-helix527-5304
β-strand5321139
β-strand533-5386138
β-strand539-5402140
β-strand544-5452140
β-strand552-5543138
α-helix555-5584
β-strand5651139
β-strand568-5736127
β-strand582-5876127
β-strand590-5956127
β-strand5961126
α-helix597-5982
β-strand599-6002141
β-strand602-609862
β-strand6131142
α-helix615-6184
β-strand629-6391162
α-helix648-6514
β-strand655-6628143
β-strand672-673262
β-strand680-6812143
β-strand684-6863143
β-strand692-700962
α-helix7101
β-strand711-7199143
α-helix726-7283
β-strand733-7342141
β-strand741-7466143
α-helix7471
β-strand7481142
α-helix749-7513
β-strand762-7676144
β-strand774-7763145
β-strand7791145
β-strand781-79010144
β-strand7951146
β-strand799-8057106
β-strand808-8103144
β-strand827-8337106
β-strand839-8468106
β-strand8511146
β-strand856-86510144
β-strand874-8829106
β-strand895-9006106
β-strand901-9055145
β-strand907-9115147
β-strand929-94012147
β-strand948-95811148
β-strand961-9622148
β-strand964-9707147
β-strand979-9846148
α-helix991-9966
β-strand1000-10012148
β-strand1007-10159148
β-strand1023-103311147
α-helix1035-10384
β-strand1046-10549148
β-strand1060-10623145
α-helix1068-10703
β-strand1071-10777148
Chain H: 29 helices, 49 β-strands
ElementResiduesLengthSheet
α-helix11-155
β-strand22-243149
α-helix36-394
β-strand40-412149
α-helix43-486
α-helix53-553
β-strand56-572149
β-strand62-654150
β-strand76-772151
β-strand80-856150
β-strand91-977151
β-strand106-1127152
α-helix115-1173
α-helix118-1247
α-helix128-1358
β-strand143-1497152
α-helix162-1665
α-helix177-1793
β-strand182-1843152
β-strand1891152
α-helix192-1998
α-helix203-2042
β-strand2121153
α-helix214-22310
β-strand235-2417152
β-strand2451153
α-helix251-2544
α-helix259-2602
β-strand2701152
α-helix272-2754
α-helix278-2814
α-helix282-29110
β-strand294-3018152
α-helix305-3128
β-strand319-3235152
α-helix330-34112
β-strand3451154
β-strand347-3493150
α-helix350-3534
β-strand356-3638151
β-strand3641155
β-strand3681155
β-strand3731151
β-strand3781154
β-strand387-3959151
α-helix398-4003
β-strand402-4087150
β-strand414-4218150
β-strand443-4442156
β-strand447-4482156
α-helix449-4513
β-strand454-4552157
β-strand461-4622157
α-helix470-4745
α-helix483-4853
β-strand488-4914158
β-strand494-4974158
α-helix498-4992
β-strand5081159
β-strand5141159
β-strand521-5222160
β-strand525-5262160
β-strand533-5364161
β-strand539-5424161
α-helix5431
β-strand546-5472162
β-strand553-5542162
β-strand5611163
β-strand5671163
β-strand572-5743164
β-strand579-5813164
α-helix597-5982
α-helix600-6023
α-helix604-6129
β-strand628-6303165
β-strand638-6436165
β-strand649-6568165
β-strand663-6675165

Molecules and chains

MoleculeChainsTypeLengthOrganismUniProt
Integrin alpha-XA, C, E, Gprotein1137Homo sapiensP20702 (AlphaFold model)
Integrin beta-2B, D, F, Hprotein727Homo sapiensP05107 (AlphaFold model)
Sequence of entity 1 (A, C, E, G), FASTA
>5ES4_1 Integrin alpha-X (chains A, C, E, G)
FNLDTEELTAFRVDSAGFGDSVVQYANSWVVVGAPQKITAANQTGGLYQCGYSTGACEPI
GLQVPPEAVNMSLGLSLASTTSPSQLLACGPTVHHECGRNMYLTGLCFLLGPTQLTQRLP
VSRQECPRQEQDIVFLIDGSGSISSRNFATMMNFVRAVISQFQRPSTQFSLMQFSNKFQT
HFTFEEFRRSSNPLSLLASVHQLQGFTYTATAIQNVVHRLFHASYGARRDAAKILIVITD
GKKEGDSLDYKDVIPMADAAGIIRYAIGVGLAFQNRNSWKELNDIASKPSQEHIFKVEDF
DALKDIQNQLKEKIFAIEGTETTSSSSFELEMAQEGFSAVFTPDGPVLGAVGSFTWSGGA
FLYPPNMSPTFINMSQENVDMRDSYLGYSTELALWKGVQSLVLGAPRYQHTGKAVIFTQV
SRQWRMKAEVTGTQIGSYFGASLCSVDVDSDGSTDLVLIGAPHYYEQTRGGQVSVCPLPR
GWRRWWCDAVLYGEQGHPWGRFGAALTVLGDVNGDKLTDVVIGAPGEEENRGAVYLFHGV
LGPSISPSHSQRIAGSQLSSRLQYFGQALSGGQDLTQDGLVDLAVGARGQVLLLRTRPVL
WVGVSMQFIPAEIPRSAFECREQVVSEQTLVQSNICLYIDKRSKNLLGSRDLQSSVTLDL
ALDPGRLSPRATFQETKNRSLSRVRVLGLKAHCENFNLLLPSCVEDSVTPITLRLNFTLV
GKPLLAFRNLRPMLAADAQRYFTASLPFEKNCGADHICQDNLGISFSFPGLKSLLVGSNL
ELNAEVMVWNDGEDSYGTTITFSHPAGLSYRYVAEGQKQGQLRSLHLTCDSAPVGSQGTW
STSCRINHLIFRGGAQITFLATFDVSPKAVLGDRLLLTANVSSENNTPRTSKTTFQLELP
VKYAVYTVVSSHEQFTKYLNFSESEEKESHVAMHRYQVNNLGQRDLPVSINFWVPVELNQ
EAVWMDVEVSHPQNPSLRCSSEKIAPPASDFLAHIQKNPVLDCSIAGCLRFRCDVPSFSV
QEELDFTLKGNLSFGWVRQILQKKVSVVSVAEITFDTSVYSQLPGQEAFMRAQTTTVLEK
YKVHGCGGLENLYFQGGENAQCEKELQALEKENAQLEWELQALEKELAQWSHPQFEK
Sequence of entity 2 (B, D, F, H), FASTA
>5ES4_2 Integrin beta-2 (chains B, D, F, H)
QECTKFKVSSCRECIESGPGCTWCQKLNFTGPGDPDSIRCDTRPQLLMRGCAADDIMDPT
SLAETQEDHNGGQKQLSPQKVTLYLRPGQAAAFNVTFRRAKGYPIDLYYLMDLSYSMLDD
LRNVKKLGGDLLRALNEITESGRIGFGSFVDKTVLPFVNTHPDKLRNPCPNKEKECQPPF
AFRHVLKLTNNSNQFQTEVGKQLISGNLDAPEGGLDAMMQVAACPEEIGWRNVTRLLVFA
TDDGFHFAGDGKLGAILTPNDGRCHLEDNLYKRSNEFDYPSVGQLAHKLAENNIQPIFAV
TSRMVKTYEKLTEIIPKSAVGELSEDSSNVVQLIKNAYNKLSSRVFLDHNALPDTLKVTY
DSFCSNGVTHRNQPRGDCDGVQINVPITFQVKVTATECIQEQSFVIRALGFTDIVTVQVL
PQCECRCRDQSRDRSLCHGKGFLECGICRCDTGYIGKNCECQTQGRSSQELEGSCRKDNN
SIICSGLGDCVCGQCLCHTSDVPGKLIYGQYCECDTINCERYNGQVCGGPGRGLCFCGKC
RCHPGFEGSACQCERTTEGCLNPRRVECSGRGRCRCNVCECHSGYQLPLCQECPGCPSPC
GKYISCAECLKFEKGPFGKNCSAACPGLQLSNNPVKGRTCKERDSEGCWVAYTLEQQDGM
DRYLIYVDESRECVDGCGLENLYFQGGKNAQCKKKLQALKKKNAQLKWKLQALKKKLAQG
GHHHHHH

Ligands and cofactors

IDNameFormulaCopies
NAG2-acetamido-2-deoxy-beta-D-glucopyranoseC8 H15 N O627
MGMagnesium ionMg1
CACalcium ionCa16

Primary citation

Leukocyte integrin alpha L beta 2 headpiece structures: The alpha I domain, the pocket for the internal ligand, and concerted movements of its loops. Sen, M., Springer, T.A. Proc Natl Acad Sci U S A (2016) 113:2940-2945. DOI 10.1073/pnas.1601379113 · PubMed

Other PDB entries of the same protein (UniProt P20702 (AlphaFold model), which also has an AlphaFold model), best resolution first:

Browse structure collections

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