Loading
PDBj
English日本語简体中文繁體中文한국어
✖
ﾒﾆｭｰPDBj@FacebookPDBj@X(formerly Twitter)PDBj@BlueSkyPDBj@YouTubewwPDB FoundationwwPDBDonate
RCSB PDBPDBeBMRBAdv. SearchSearch help
1G1
1G1
表記:N3Phe-Leu-Leu-Phe(4-NH2CH2)-methyl vinyl sulfone, bound form
組成式:C33 H49 N7 O5 S
SMILES:NCc1ccc(CC(CCS(C)(=O)=O)NC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)C(Cc2ccccc2)/N=[N+]=[N-])cc1
InChi:InChI=1S/C33H49N7O5S/c1-22(2)17-28(31(41)36-27(15-16-46(5,44)45)19-25-11-13-26(21-34)14-12-25)37-32(42)29(18-23(3)4)38-33(43)30(39-40-35)20-24-9-7-6-8-10-24/h6-14,22-23,27-30H,15-21,34H2,1-5H3,(H,36,41)(H,37,42)(H,38,43)/t27-,28+,29+,30+/m1/s1
定義日:2013-01-22
最終更新日:2024-09-27
公開日:2013-01-25
識別子（ID）:N-[(2S)-2-azido-3-phenylpropanoyl]-L-leucyl-N-[(2S)-1-[4-(aminomethyl)phenyl]-4-(methanesulfonyl)butan-2-yl]-L-leucinamide
G9S
G9S
表記:S-[2-({N-[(2S)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alanyl}amino)ethyl] hexadecanethioate
組成式:C27 H53 N2 O8 P S
SMILES:C(NC(CCNC(C(C(C)(COP(O)(=O)O)C)O)=O)=O)CSC(CCCCCCCCCCCCCCC)=O
InChi:InChI=1S/C27H53N2O8PS/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24(31)39-21-20-28-23(30)18-19-29-26(33)25(32)27(2,3)22-37-38(34,35)36/h25,32H,4-22H2,1-3H3,(H,28,30)(H,29,33)(H2,34,35,36)/t25-/m1/s1
定義日:2018-05-16
最終更新日:2024-09-27
公開日:2019-04-03
識別子（ID）:S-[2-({N-[(2S)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alanyl}amino)ethyl] hexadecanethioate
ODA
ODA
表記:9-AMINO-6,10-DIOXO-OCTAHYDRO-PYRIDAZINO[1,2-A][1,2]DIAZEPINE-1-CARBOXYLIC ACID
組成式:C10 H15 N3 O4
SMILES:O=C(O)C2N1C(=O)C(N)CCC(=O)N1CCC2
InChi:InChI=1S/C10H15N3O4/c11-6-3-4-8(14)12-5-1-2-7(10(16)17)13(12)9(6)15/h6-7H,1-5,11H2,(H,16,17)/t6-,7-/m0/s1
定義日:1999-10-14
最終更新日:2024-09-27
識別子（ID）:(1S,9S)-9-amino-6,10-dioxooctahydro-6H-pyridazino[1,2-a][1,2]diazepine-1-carboxylic acid
ODC
ODC
表記:2-chloranyl-~{N}-[2-[1-[2-(4-chloranylphenoxy)-2-methyl-propanoyl]piperidin-4-yl]ethyl]ethanamide
組成式:C19 H26 Cl2 N2 O3
SMILES:CC(C)(Oc1ccc(Cl)cc1)C(=O)N2CCC(CCNC(=O)CCl)CC2
InChi:InChI=1S/C19H26Cl2N2O3/c1-19(2,26-16-5-3-15(21)4-6-16)18(25)23-11-8-14(9-12-23)7-10-22-17(24)13-20/h3-6,14H,7-13H2,1-2H3,(H,22,24)
定義日:2022-09-05
最終更新日:2024-09-27
公開日:2023-09-20
識別子（ID）:2-chloranyl-~{N}-[2-[1-[2-(4-chloranylphenoxy)-2-methyl-propanoyl]piperidin-4-yl]ethyl]ethanamide
1G5
1G5
表記:HMB-Val-Ser-Phe(4-NH2CH2)-methyl vinyl sulfone, bound form
組成式:C28 H40 N4 O7 S
SMILES:O=S(=O)(C)CCC(NC(=O)C(NC(=O)C(NC(=O)c1cccc(O)c1C)C(C)C)CO)Cc2ccc(cc2)CN
InChi:InChI=1S/C28H40N4O7S/c1-17(2)25(32-26(35)22-6-5-7-24(34)18(22)3)28(37)31-23(16-33)27(36)30-21(12-13-40(4,38)39)14-19-8-10-20(15-29)11-9-19/h5-11,17,21,23,25,33-34H,12-16,29H2,1-4H3,(H,30,36)(H,31,37)(H,32,35)/t21-,23+,25+/m1/s1
定義日:2013-01-22
最終更新日:2024-09-27
公開日:2013-01-25
識別子（ID）:N-(3-hydroxy-2-methylbenzoyl)-L-valyl-N-[(2S)-1-[4-(aminomethyl)phenyl]-4-(methylsulfonyl)butan-2-yl]-L-serinamide
1G6
1G6
表記:N3Phe-Phe(4-NH2CH2)-Leu-Phe(4-NH2CH2)-methyl vinyl sulfone, bound form
組成式:C37 H50 N8 O5 S
SMILES:NCc1ccc(CC(CCS(C)(=O)=O)NC(=O)C(CC(C)C)NC(=O)C(Cc2ccc(CN)cc2)NC(=O)C(Cc2ccccc2)N=[N+]=[N-])cc1
InChi:InChI=1S/C37H50N8O5S/c1-25(2)19-32(35(46)41-31(17-18-51(3,49)50)20-27-9-13-29(23-38)14-10-27)42-36(47)33(21-28-11-15-30(24-39)16-12-28)43-37(48)34(44-45-40)22-26-7-5-4-6-8-26/h4-16,25,31-34H,17-24,38-39H2,1-3H3,(H,41,46)(H,42,47)(H,43,48)/t31-,32+,33-,34+/m1/s1
定義日:2013-01-22
最終更新日:2024-09-27
公開日:2013-01-25
識別子（ID）:4-(aminomethyl)-N-[(2S)-2-azido-3-phenylpropanoyl]-D-phenylalanyl-N-[(2S)-1-[4-(aminomethyl)phenyl]-4-(methanesulfonyl)butan-2-yl]-L-leucinamide
PLZ
PLZ
表記:4-[({3-HYDROXY-2-METHYL-5-[(PHOSPHONOOXY)METHYL]PYRIDIN-4-YL}METHYL)AMINO]BUTANOIC ACID
組成式:C12 H19 N2 O7 P
SMILES:O=P(O)(O)OCc1cnc(c(O)c1CNCCCC(=O)O)C
InChi:InChI=1S/C12H19N2O7P/c1-8-12(17)10(6-13-4-2-3-11(15)16)9(5-14-8)7-21-22(18,19)20/h5,13,17H,2-4,6-7H2,1H3,(H,15,16)(H2,18,19,20)
定義日:2007-01-18
最終更新日:2024-09-27
識別子（ID）:4-[({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methyl)amino]butanoic acid
PM3
PM3
表記:2-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)-PROPIONIC ACID
組成式:C10 H14 N O5 P
SMILES:O=C(O)C(N)Cc1ccc(cc1)CP(=O)(O)O
InChi:InChI=1S/C10H14NO5P/c11-9(10(12)13)5-7-1-3-8(4-2-7)6-17(14,15)16/h1-4,9H,5-6,11H2,(H,12,13)(H2,14,15,16)/t9-/m0/s1
定義日:2006-05-03
最終更新日:2024-09-27
識別子（ID）:4-(phosphonomethyl)-L-phenylalanine
PM4
PM4
表記:S-(2-{[N-(2-HYDROXY-4-{[HYDROXY(OXIDO)PHOSPHINO]OXY}-3,3-DIMETHYLBUTANOYL)-BETA-ALANYL]AMINO}ETHYL) HEXANETHIOATE
組成式:C17 H33 N2 O7 P S
SMILES:O=C(SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)O)CCCCC
InChi:InChI=1S/C17H33N2O7PS/c1-4-5-6-7-14(21)28-11-10-18-13(20)8-9-19-16(23)15(22)17(2,3)12-26-27(24)25/h15,22,27H,4-12H2,1-3H3,(H,18,20)(H,19,23)(H,24,25)/t15-/m0/s1
定義日:2005-12-19
最終更新日:2024-09-27
識別子（ID）:S-[2-({N-[(2R)-2-hydroxy-4-{[(R)-hydroxy(oxido)phosphanyl]oxy}-3,3-dimethylbutanoyl]-beta-alanyl}amino)ethyl] hexanethioate
PM5
PM5
表記:S-(2-{[N-(2-HYDROXY-4-{[HYDROXY(OXIDO)PHOSPHINO]OXY}-3,3-DIMETHYLBUTANOYL)-BETA-ALANYL]AMINO}ETHYL) HEPTANETHIOATE
組成式:C18 H35 N2 O7 P S
SMILES:O=C(SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)O)CCCCCC
InChi:InChI=1S/C18H35N2O7PS/c1-4-5-6-7-8-15(22)29-12-11-19-14(21)9-10-20-17(24)16(23)18(2,3)13-27-28(25)26/h16,23,28H,4-13H2,1-3H3,(H,19,21)(H,20,24)(H,25,26)/t16-/m0/s1
定義日:2005-12-19
最終更新日:2024-09-27
識別子（ID）:S-[2-({N-[(2R)-2-hydroxy-4-{[(R)-hydroxy(oxido)phosphanyl]oxy}-3,3-dimethylbutanoyl]-beta-alanyl}amino)ethyl] heptanethioate
PM8
PM8
表記:S-(2-{[N-(2-HYDROXY-4-{[HYDROXY(OXIDO)PHOSPHINO]OXY}-3,3-DIMETHYLBUTANOYL)-BETA-ALANYL]AMINO}ETHYL) DECANETHIOATE
組成式:C21 H41 N2 O7 P S
SMILES:O=C(SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)O)CCCCCCCCC
InChi:InChI=1S/C21H41N2O7PS/c1-4-5-6-7-8-9-10-11-18(25)32-15-14-22-17(24)12-13-23-20(27)19(26)21(2,3)16-30-31(28)29/h19,26,31H,4-16H2,1-3H3,(H,22,24)(H,23,27)(H,28,29)/t19-/m0/s1
定義日:2005-12-19
最終更新日:2024-09-27
識別子（ID）:S-[2-({N-[(2R)-2-hydroxy-4-{[(R)-hydroxy(oxido)phosphanyl]oxy}-3,3-dimethylbutanoyl]-beta-alanyl}amino)ethyl] decanethioate
GAF
GAF
表記:2-deoxy-2-fluoro-alpha-D-galactopyranose
組成式:C6 H11 F O5
SMILES:FC1C(O)C(O)C(OC1O)CO
InChi:InChI=1S/C6H11FO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1H2/t2-,3-,4+,5-,6+/m1/s1
別名:2-DEOXY-2-FLUORO-GALACTOSE
定義日:2004-02-11
最終更新日:2024-09-27
識別子（ID）:2-deoxy-2-fluoro-alpha-D-galactopyranose
1GP
1GP
表記:SN-GLYCEROL-1-PHOSPHATE
組成式:C3 H9 O6 P
SMILES:O=P(O)(O)OCC(O)CO
InChi:InChI=1S/C3H9O6P/c4-1-3(5)2-9-10(6,7)8/h3-5H,1-2H2,(H2,6,7,8)/t3-/m0/s1
定義日:2005-12-27
最終更新日:2024-09-27
識別子（ID）:(2S)-2,3-dihydroxypropyl dihydrogen phosphate
GAL
GAL
表記:beta-D-galactopyranose
組成式:C6 H12 O6
SMILES:OC1C(O)C(OC(O)C1O)CO
InChi:InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3+,4+,5-,6-/m1/s1
別名:beta-D-galactose
定義日:1999-07-08
最終更新日:2024-09-27
識別子（ID）:beta-D-galactopyranose
PMI
PMI
表記:(2-AMINO-2,3-DIHYDRO-1H-INDEN-2-YL)PHOSPHONIC ACID
組成式:C9 H12 N O3 P
SMILES:O=P(O)(O)C2(N)Cc1ccccc1C2
InChi:InChI=1S/C9H12NO3P/c10-9(14(11,12)13)5-7-3-1-2-4-8(7)6-9/h1-4H,5-6,10H2,(H2,11,12,13)
別名:2-AMINOINDAN-2-PHOSPHONIC ACID
定義日:2006-12-14
最終更新日:2024-09-27
識別子（ID）:(2-amino-2,3-dihydro-1H-inden-2-yl)phosphonic acid
GAQ
GAQ
表記:5-HYDROXYPENTANAL
組成式:C5 H10 O2
SMILES:O=CCCCCO
InChi:InChI=1S/C5H10O2/c6-4-2-1-3-5-7/h4,7H,1-3,5H2
定義日:2005-08-02
最終更新日:2024-09-27
識別子（ID）:5-hydroxypentanal
GAU
GAU
表記:(4S)-4-AMINO-5-HYDROXYPENTANOIC ACID
組成式:C5 H11 N O3
SMILES:O=C(O)CCC(N)CO
InChi:InChI=1S/C5H11NO3/c6-4(3-7)1-2-5(8)9/h4,7H,1-3,6H2,(H,8,9)/t4-/m0/s1
別名:L-GLUTAMOL
定義日:2005-06-02
最終更新日:2024-09-27
識別子（ID）:(4S)-4-amino-5-hydroxypentanoic acid
PMP
PMP
表記:4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE
組成式:C8 H13 N2 O5 P
SMILES:O=P(O)(O)OCc1cnc(c(O)c1CN)C
InChi:InChI=1S/C8H13N2O5P/c1-5-8(11)7(2-9)6(3-10-5)4-15-16(12,13)14/h3,11H,2,4,9H2,1H3,(H2,12,13,14)
別名:PYRIDOXAMINE-5'-PHOSPHATE
定義日:1999-07-08
最終更新日:2024-09-27
識別子（ID）:[4-(aminomethyl)-5-hydroxy-6-methylpyridin-3-yl]methyl dihydrogen phosphate
PMQ
PMQ
表記:benzylcarbamic acid
組成式:C8 H9 N O2
SMILES:O=C(O)NCc1ccccc1
InChi:InChI=1S/C8H9NO2/c10-8(11)9-6-7-4-2-1-3-5-7/h1-5,9H,6H2,(H,10,11)
定義日:2012-03-15
最終更新日:2024-09-27
識別子（ID）:benzylcarbamic acid
PMS
PMS
表記:phenylmethanesulfonic acid
組成式:C7 H8 O3 S
SMILES:O=S(=O)(O)Cc1ccccc1
InChi:InChI=1S/C7H8O3S/c8-11(9,10)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,8,9,10)
定義日:2009-08-24
最終更新日:2024-09-27
識別子（ID）:phenylmethanesulfonic acid
GB
GB
表記:METHYLPHOSPHONIC ACID ESTER GROUP
組成式:C H5 O3 P
SMILES:O=P(O)(O)C
InChi:InChI=1S/CH5O3P/c1-5(2,3)4/h1H3,(H2,2,3,4)
定義日:1999-07-08
最終更新日:2024-09-27
識別子（ID）:methylphosphonic acid
1HB
1HB
表記:(4S)-4-amino-5-hydroxy-N,N-dimethylpentanamide
組成式:C7 H16 N2 O2
SMILES:O=C(N(C)C)CCC(N)CO
InChi:InChI=1S/C7H16N2O2/c1-9(2)7(11)4-3-6(8)5-10/h6,10H,3-5,8H2,1-2H3/t6-/m0/s1
別名:N,N-dimethyl-L-glutamine aldehyde, bound form
定義日:2013-02-04
最終更新日:2024-09-27
公開日:2013-02-15
識別子（ID）:(4S)-4-amino-5-hydroxy-N,N-dimethylpentanamide
1HD
1HD
表記:N-[(2S)-2-amino-3-hydroxypropyl]acetamide
組成式:C5 H12 N2 O2
SMILES:O=C(NCC(N)CO)C
InChi:InChI=1S/C5H12N2O2/c1-4(9)7-2-5(6)3-8/h5,8H,2-3,6H2,1H3,(H,7,9)/t5-/m0/s1
定義日:2013-02-05
最終更新日:2024-09-27
公開日:2013-02-15
識別子（ID）:N-[(2S)-2-amino-3-hydroxypropyl]acetamide
PN2
PN2
表記:4'-(3-AMINOPROPIONIC) PHOSPHOPANTETHEINE
組成式:C14 H26 N3 O8 P S
SMILES:O=C(NCCS)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OCC(=C=O)/N
InChi:InChI=1S/C14H26N3O8PS/c1-14(2,9-25-26(22,23)24-8-10(15)7-18)12(20)13(21)17-4-3-11(19)16-5-6-27/h12,20,27H,3-6,8-9,15H2,1-2H3,(H,16,19)(H,17,21)(H,22,23)/t12-/m0/s1
別名:2-AMINO-3-(HYDROXY-(3-HYDROXY-3-[2-(MERCAPTO-ETHYLCARBAMOYL]-2,2-DIMETHYL-PROPOXY-PHOSPHORYLOXY)-PROPIONIC ACID
定義日:2000-07-13
最終更新日:2024-09-27
識別子（ID）:N~3~-[(2R)-4-{[(S)-[(2-amino-3-oxoprop-2-en-1-yl)oxy](hydroxy)phosphoryl]oxy}-2-hydroxy-3,3-dimethylbutanoyl]-N-(2-sulfanylethyl)-beta-alaninamide
PN7
PN7
表記:N~3~-[(2S)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-N-(2-sulfanylethyl)-beta-alaninamide
組成式:C11 H23 N2 O7 P S
SMILES:OC(C(C)(COP(O)(O)=O)C)C(=O)NCCC(NCCS)=O
InChi:InChI=1S/C11H23N2O7PS/c1-11(2,7-20-21(17,18)19)9(15)10(16)13-4-3-8(14)12-5-6-22/h9,15,22H,3-7H2,1-2H3,(H,12,14)(H,13,16)(H2,17,18,19)/t9-/m1/s1
定義日:2015-07-16
最終更新日:2024-09-27
公開日:2016-01-20
識別子（ID）:N~3~-[(2S)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-N-(2-sulfanylethyl)-beta-alaninamide

238582

件を2025-07-09に公開中

PDB statisticsPDBj update infoContact PDBjnumon