X-ray Structures

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Target 511327

Title: CRYSTAL STRUCTURE OF AN ABC TRANSPORTER SOLUTE BINDING PROTEIN (IPR025997) FROM MYCOBACTERIUM SMEGMATIS (MSMEI_3018, TARGET EFI-511327) WITH BOUND GLYCEROL
Authors: M.W.Vetting,Y.Patskovsky,N.F.Al Obaidi,R.Toro,L.L.Morisco,J.Benach,J.Koss,S.R.Wasserman,J.D.Attonito,A.Scott Glenn,S.Chamala,S.Chowdhury,J.Lafleur,J.Love,R.D.Seidel,K.L.Whalen,J.A.Gerlt,S.C.Almo,Enzyme Function Initiative (Efi)
PDB 4YV7 (PDBSUM) (Profunc) (GPSS) (MMDB)
Other ligands: glycerol
R: 17.7%
Rfree: 23.8%
Resolution: 2.3Å
Deposited: 2015-03-19
Released:

Target 511115

Title: CRYSTAL STRUCTURE OF AN ABC TRANSPORTER SOLUTE BINDING PROTEIN (IPR025997) FROM BURKHOLDERIA MULTIVORANS (Bmul_1631, TARGET EFI-511115) WITH AN UNKNOWN LIGAND MODELLED AS ALPHA-D-ERYTHROFURANOSE
Authors: M.W.Vetting,N.F.Al Obaidi,R.Toro,L.L.Morisco,J.Benach,J.Koss,S.R.Wasserman,J.D.Attonito,A.Scott Glenn,S.Chamala,S.Chowdhury,J.Lafleur,J.Love,R.D.Seidel,K.L.Whalen,J.A.Gerlt,S.C.Almo,Enzyme Function Initiative (Efi)
PDB 4YLE (PDBSUM) (Profunc) (GPSS) (MMDB)
Complexed with: unknown carbohydrate-like ligand
R: 17.1%
Rfree: 21.1%
Resolution: 1.7Å
Deposited: 2015-03-05
Released:

Target 511490

Title: CRYSTAL STRUCTURE OF AN ABC TRANSPORTER SOLUTE BINDING PROTEIN (IPR025997) FROM BRADYRHIZOBIUM sp. BTAi1 (BBta_2440, TARGET EFI-511490) WITH BOUND BIS-TRIS
Authors: M.W.Vetting,N.F.Al Obaidi,R.Toro,L.L.Morisco,J.Benach,J.Koss,S.R.Wasserman,J.D.Attonito,A.Scott Glenn,S.Chamala,S.Chowdhury,J.Lafleur,J.Love,R.D.Seidel,K.L.Whalen,J.A.Gerlt,S.C.Almo,Enzyme Function Initiative (Efi)
PDB 4YHS (PDBSUM) (Profunc) (GPSS) (MMDB)
Other ligands: , 2-[bis-(2-hydroxy-ethyl)-amino]-2-hydroxymethyl-propane-1,3-diol
R: 18.14%
Rfree: 22.7%
Resolution: 1.8Å
Deposited: 2015-02-27
Released:

Target 511224

Title: CRYSTAL STRUCTURE OF AN ABC TRANSPORTER SOLUTE BINDING PROTEIN (IPR025997) FROM AGROBACTERIUM VITIS S4 (Avi_5305, TARGET EFI-511224) WITH BOUND ALPHA-D-GLUCOSAMINE
Authors: M.W.Vetting,N.F.Al Obaidi,R.Toro,L.L.Morisco,J.Benach,J.Koss,S.R.Wasserman,J.D.Attonito,A.Scott Glenn,S.Chamala,S.Chowdhury,J.Lafleur,J.Love,R.D.Seidel,K.L.Whalen,J.A.Gerlt,S.C.Almo,Enzyme Function Initiative (Efi)
PDB 4Y9T (PDBSUM) (Profunc) (GPSS) (MMDB)
Complexed with: paromomycin (ring 1)
R: 14.8%
Rfree: 18.9%
Resolution: 1.8Å
Deposited: 2015-02-17
Released:

Target 510114

Title: CRYSTAL STRUCTURE OF A TRAP PERIPLASMIC SOLUTE BINDING PROTEIN FROM DESULFOVIBRIO VULGARIS (Deval_0042, TARGET EFI-510114) BOUND TO COPURIFIED (R)-PANTOIC ACID
Authors: M.W.Vetting,N.F.Al Obaidi,R.Toro,L.L.Morisco,J.Benach,S.R.Wasserman,J.D.Attonito,A.Scott Glenn,S.Chamala,S.Chowdhury,J.Lafleur,J.Love,R.D.Seidel,K.L.Whalen,J.A.Gerlt,S.C.Almo,Enzyme Function Initiative (Efi)
PDB 4XEQ (PDBSUM) (Profunc) (GPSS) (MMDB)
Complexed with: 5,6-dihydro-benzo[h]cinnolin-3-ylamine
R: 15.7%
Rfree: 18.5%
Resolution: 1.7Å
Deposited: 2014-12-24
Released: 2015-01-28

Target 511009

Title: CRYSTAL STRUCTURE OF CARBOHYDRATE TRANSPORTER SOLUTE BINDING PROTEIN VEIS_2079 FROM VERMINEPHROBACTER EISENIAE EF01-2, TARGET EFI-511009, A COMPLEX WITH D-TALITOL
Authors: Y.Patskovsky,R.Toro,R.Bhosle,N.Al Obaidi,L.L.Morisco,S.R.Wasserman,S.Chamala,J.D.Attonito,A.Scott Glenn,S.Chowdhury,J.Lafleur,B.Hillerich,R.D.Siedel,J.Love,K.L.Whalen,J.A.Gerlt,S.C.Almo,Enzyme Function Initiative (Efi)
PDB 4RY9 (PDBSUM) (Profunc) (GPSS) (MMDB)
R: 12.4%
Rfree: 15.1%
Resolution: 1.4Å
Deposited: 2014-12-13
Released:

Target 510645

Title: CRYSTAL STRUCTURE OF ABC TRANSPORTER SOLUTE BINDING PROTEIN AVI_3567 FROM AGROBACTERIUM VITIS S4, TARGET EFI-510645, WITH BOUND D-MANNITOL
Authors: Y.Patskovsky,R.Toro,R.Bhosle,N.Al Obaidi,L.L.Morisco,S.R.Wasserman,S.Chamala,J.D.Attonito,A.Scott Glenn,S.Chowdhury,J.Lafleur,B.Hillerich,R.D.Siedel,J.Love,K.L.Whalen,J.A.Gerlt,S.C.Almo,Enzyme Function Initiative (Efi)
PDB 4RYA (PDBSUM) (Profunc) (GPSS) (MMDB)
Other ligands: acetate ion, d-mannitol
R: 13.3%
Rfree: 16.8%
Resolution: 1.5Å
Deposited: 2014-12-13
Released:

Target 510913

Title: CRYSTAL STRUCTURE OF MOLYBDENUM ABC TRANSPORTER VC_A0726 FROM , TARGET EFI-510913, IN COMPLEX WITH TUNGSTATE
Authors: Y.Patskovsky,R.Toro,R.Bhosle,N.Al Obaidi,L.L.Morisco,S.R.Wasserman,S.Chamala,J.D.Attonito,A.Scott Glenn,S.Chowdhury,J.Lafleur,B.Hillerich,R.D.Siedel,J.Love,K.L.Whalen,J.A.Gerlt,S.C.Almo,Enzyme Function Initiative (Efi)
PDB 4RXL (PDBSUM) (Profunc) (GPSS) (MMDB)
Other ligands: tungstate(vi)ion
R: 17.2%
Rfree: 21%
Resolution: 1.52Å
Deposited: 2014-12-11
Released:

Target 510338

Title: Crystal structure of a TctC solute binding protein from Polaromonas (Bpro_3516, Target EFI-510338), no ligand
Authors: U.Yadava,M.W.Vetting,N.F.Al Obaidi,R.Toro,L.L.Morisco,J.Benach,S.R.Wasserman,J.D.Attonito,A.Scott Glenn,S.Chamala,S.Chowdhury,J.Lafleur,J.Love,R.D.Seidel,K.L.Whalen,J.A.Gerlt,S.C.Almo,Enzyme Function Initiative (Efi)
PDB 4X9T (PDBSUM) (Profunc) (GPSS) (MMDB)
Other ligands: ,
R: 16.3%
Rfree: 19%
Resolution: 1.24Å
Deposited: 2014-12-11
Released:

Target 511105

Title: CRYSTAL STRUCTURE OF PERIPLASMIC ABC TRANSPORTER SOLUTE BINDING PROTEIN A7JW62 FROM MANNHEIMIA HAEMOLYTICA PHL213, TARGET EFI-511105, IN COMPLEX WITH MYO-INOSITOL
Authors: Y.Patskovsky,R.Toro,R.Bhosle,N.Al Obaidi,L.L.Morisco,S.R.Wasserman,S.Chamala,J.D.Attonito,A.Scott Glenn,S.Chowdhury,J.Lafleur,B.Hillerich,R.D.Siedel,J.Love,K.L.Whalen,J.A.Gerlt,S.C.Almo,Enzyme Function Initiative (Efi)
PDB 4RXM (PDBSUM) (Profunc) (GPSS) (MMDB)
Other ligands: , ,
R: 15.7%
Rfree: 18.7%
Resolution: 1.75Å
Deposited: 2014-12-11
Released:

Target 510205

Title: CRYSTAL STRUCTURE OF A TRAP PERIPLASMIC SOLUTE BINDING PROTEIN FROM Rhodobacter sphaeroides (Rsph17029_2138, TARGET EFI-510205) WITH BOUND Glucuronate
Authors: U.Yadava,M.W.Vetting,N.F.Al Obaidi,R.Toro,L.L.Morisco,J.Benach,S.R.Wasserman,J.D.Attonito,A.Scott Glenn,S.Chamala,S.Chowdhury,J.Lafleur,J.Love,R.D.Seidel,K.L.Whalen,J.A.Gerlt,S.C.Almo,Enzyme Function Initiative (Efi)
PDB 4X8R (PDBSUM) (Profunc) (GPSS) (MMDB)
Complexed with: beta-d-galactopyranuronic acid
Other ligands: phosphate ion
R: 15.7%
Rfree: 20.1%
Resolution: 1.9Å
Deposited: 2014-12-10
Released: 2014-12-24

Target 510180

Title: CRYSTAL STRUCTURE OF A TRAP PERIPLASMIC SOLUTE BINDING PROTEIN FROM PSEUDOALTEROMONAS ATLANTICA T6c (Patl_2292, TARGET EFI-510180) WITH BOUND SODIUM AND PYRUVATE
Authors: U.Yadava,M.W.Vetting,N.F.Al Obaidi,R.Toro,L.L.Morisco,J.Benach,S.R.Wasserman,J.D.Attonito,A.Scott Glenn,S.Chamala,S.Chowdhury,J.Lafleur,J.Love,R.D.Seidel,K.L.Whalen,J.A.Gerlt,S.C.Almo,Enzyme Function Initiative (Efi)
PDB 4X26 (PDBSUM) (Profunc) (GPSS) (MMDB)
Complexed with: pyruvic acid, sodium ion
R: 16.4%
Rfree: 22.9%
Resolution: 2.1Å
Deposited: 2014-11-26
Released: 2014-12-17

Target 511148

Title: Primary Citation CRYSTAL STRUCTURE OF AN ABC TRANSPORTER SOLUTE BINDING PROTEIN (IPR025997) FROM CLOSTRIDIUM PHYTOFERMENTAS (Cphy_0583, TARGET EFI-511148) WITH BOUND L-RHAMNOSE
Authors: M.W.Vetting,N.F.Al Obaidi,R.Toro,L.L.Morisco,J.Benach,S.R.Wasserman,J.D.Attonito,A.Scott Glenn,S.Chamala,S.Chowdhury,J.Lafleur,J.Love,R.D.Seidel,K.L.Whalen,J.A.Gerlt,S.C.Almo,Enzyme Function Initiative (Efi)
PDB 4WZZ (PDBSUM) (Profunc) (GPSS) (MMDB)
Complexed with: alpha-l-rhamnose
Other ligands: 1,2-ethanediol
R: 14.5%
Rfree: 18.1%
Resolution: 1.7Å
Deposited: 2014-11-20
Released: 2014-12-17

Target 510965

Title: Crystal structure of carbohydrate transporter ACEI_1806 from Acidothermus cellulolyticus 11B, TARGET EFI-510965, in complex with myo-inositol
Authors: Y.Patskovsky,R.Toro,R.Bhosle,N.Al Obaidi,L.L.Morisco,S.R.Wasserman,S.Chamala,J.D.Attonito,A.Scott Glenn,S.Chowdhury,J.Lafleur,B.Hillerich,R.D.Siede,J.Love,K.L.Whalen,J.A.Gerlt,S.C.Almo,Enzyme Function Initiative (Efi)
PDB 4RU1 (PDBSUM) (Profunc) (GPSS) (MMDB)
Other ligands: ,
R: 18.6%
Rfree: 22.6%
Resolution: 1.5Å
Deposited: 2014-11-17
Released: 2014-12-17

Target 512911

Title: CRYSTAL STRUCTURE OF A LACI REGULATOR FROM LACTOBACILLUS CASEI (LSEI_2103, TARGET EFI-512911) WITH BOUND TRIS
Authors: M.W.Vetting,N.F.Al Obaidi,R.Toro,L.L.Morisco,J.Benach,S.R.Wasserman,J.D.Attonito,A.Scott Glenn,S.Chamala,S.Chowdhury,J.Lafleur,J.Love,R.D.Seidel,K.L.Whalen,J.A.Gerlt,S.C.Almo,Enzyme Function Initiative (Efi)
PDB 4WXE (PDBSUM) (Profunc) (GPSS) (MMDB)
Other ligands: , 1,2-ethanediol, 2-amino-2-hydroxymethyl-propane-1,3-diol, magnesium ion
R: 14.6%
Rfree: 16.8%
Resolution: 1.5Å
Deposited: 2014-11-13
Released: 2014-11-26

Target 510967

Title: CRYSTAL STRUCTURE OF AN ABC TRANSPORTER SOLUTE BINDING PROTEIN (IPR025997) FROM MYCOBACTERIUM SMEGMATIS (MSMEG_1704, TARGET EFI-510967) WITH BOUND D-GALACTOSE
Authors: M.W.Vetting,N.F.Al Obaidi,R.Toro,L.L.Morisco,J.Benach,S.R.Wasserman,J.D.Attonito,A.Scott Glenn,S.Chamala,S.Chowdhury,J.Lafleur,J.Love,R.D.Seidel,K.L.Whalen,J.A.Gerlt,S.C.Almo,Enzyme Function Initiative (Efi)
PDB 4WWH (PDBSUM) (Profunc) (GPSS) (MMDB)
Complexed with: beta-d-galactose
Other ligands: 2-amino-2-hydroxymethyl-propane-1,3-diol
R: 13.9%
Rfree: 15.4%
Resolution: 1.2Å
Deposited: 2014-11-11
Released: 2014-11-26

Target 510970

Title: Crystal structure of carbohydrate transporter msmeg_3599 from mycobacterium smegmatis str. mc2 155, target EFI-510970, in complex with l-threitol
Authors: Y.Patskovsky,R.Toro,R.Bhosle,N.Al Obaidi,L.L.Morisco,S.R.Wasserman,S.Chamala,J.D.Attonito,A.Scott Glenn,S.Chowdhury,J.Lafleur,B.Hillerich,R.D.Siedel,J.Love,K.L.Whalen,J.A.Gerlt,S.C.Almo,Enzyme Function Initiative (Efi)
PDB 4RSM (PDBSUM) (Profunc) (GPSS) (MMDB)
Other ligands: (2r,3s,4r,5r,6r)-6-((1r,2r,3s,4r,6s)-4,6-diamino-2,3-di hydroxycyclohexyloxy)-5-amino-2-(aminomethyl)-tetrahydr o-2h-pyran-3,4-diol
R: 17.8%
Rfree: 21.7%
Resolution: 1.6Å
Deposited: 2014-11-08
Released:

Target 510969

Title: Crystal structure of carbohydrate transporter A0QYB3 from Mycobacterium smegmatis str. MC2 155, target EFI-510969, in complex with xylitol
Authors: Y.Patskovsky,R.Toro,R.Bhosle,N.Al Obaidi,L.L.Morisco,S.R.Wasserman,S.Chamala,J.D.Attonito,A.Scott Glenn,S.Chowdhury,J.Lafleur,B.Hillerich,R.D.Siedel,J.Love,K.L.Whalen,J.A.Gerlt,S.C.Almo,Enzyme Function Initiative (Efi)
PDB 4RS3 (PDBSUM) (Profunc) (GPSS) (MMDB)
Other ligands: , acetate ion, d-xylitol, imidazole, zinc ion
R: 12.5%
Rfree: 16.3%
Resolution: 1.4Å
Deposited: 2014-11-06
Released: 2014-11-19

Target 513796

Title: Crystal structure of a putative D-Mannonate oxidoreductase from Haemophilus influenza (Avi_5165, TARGET EFI-513796) with bound NAD
Authors: U.Yadava,M.W.Vetting,N.F.Al Obaidi,R.Toro,L.L.Morisco,J.Benach,S.R.Wasserman,J.D.Attonito,A.Scott Glenn,S.Chamala,S.Chowdhury,J.Lafleur,J.Love,R.D.Seidel,K.L.Whalen,J.A.Gerlt,S.C.Almo
PDB 4WUV (PDBSUM) (Profunc) (GPSS) (MMDB)
Complexed with: nicotinamide adenine dinucleotide
Other ligands: 1,2-ethanediol
R: 14.1%
Rfree: 17.2%
Resolution: 1.55Å
Deposited: 2014-11-03
Released: 2014-11-26

Target 511220

Title: CRYSTAL STRUCTURE OF AN ABC TRANSPORTER SOLUTE BINDING PROTEIN (IPR025997) FROM AGROBACTERIUM VITIS (Avi_5133, TARGET EFI-511220) WITH BOUND D-FUCOSE
Authors: M.W.Vetting,N.F.Al Obaidi,R.Toro,L.L.Morisco,J.Benach,S.R.Wasserman,J.D.Attonito,A.Scott Glenn,S.Chamala,S.Chowdhury,J.Lafleur,J.Love,R.D.Seidel,K.L.Whalen,J.A.Gerlt,S.C.Almo,Enzyme Function Initiative (Efi)
PDB 4WUT (PDBSUM) (Profunc) (GPSS) (MMDB)
Complexed with: beta-d-fucose
Other ligands: , calcium ion
R: 18.4%
Rfree: 20.7%
Resolution: 1.5Å
Deposited: 2014-11-03
Released: 2014-12-17
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