Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c1c08bf73c42e32f82e320aaf68e2d6e",
"space_group_name": "P 41 21 2",
"unit_cell": {
"a": 88.173,
"b": 88.173,
"c": 432.956,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.25441],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.2700,2.000],
"number_observations_unique": 194236,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.132
},
{
"type": "I/SigI",
"value": 11.900
},
{
"type": "Completeness",
"value": 89.800
}
]
},
"refln_shells": [
{
"resolution_limits": [2.050,2.000],
"number_observations": 16104,
"number_observations_unique": 8048,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 0.6
},
{
"type": "Completeness",
"value": 50.400
}
]
},
{
"resolution_limits": [2.110,2.050],
"number_observations": 19894,
"number_observations_unique": 9078,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 0.8
},
{
"type": "Completeness",
"value": 58.200
}
]
},
{
"resolution_limits": [2.170,2.110],
"number_observations": 24312,
"number_observations_unique": 10290,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 1.1
},
{
"type": "Completeness",
"value": 67.700
}
]
},
{
"resolution_limits": [2.240,2.170],
"number_observations": 46023,
"number_observations_unique": 12299,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Completeness",
"value": 83.400
}
]
},
{
"resolution_limits": [2.310,2.240],
"number_observations": 76138,
"number_observations_unique": 14092,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 2.1
},
{
"type": "Completeness",
"value": 98.400
}
]
},
{
"resolution_limits": [2.390,2.310],
"number_observations": 87427,
"number_observations_unique": 13813,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 2.8
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [2.480,2.390],
"number_observations": 84285,
"number_observations_unique": 13322,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 3.5
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [2.580,2.480],
"number_observations": 81599,
"number_observations_unique": 12868,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 4.3
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [2.700,2.580],
"number_observations": 78087,
"number_observations_unique": 12261,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 5.3
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [2.830,2.700],
"number_observations": 75243,
"number_observations_unique": 11798,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 7.0
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [2.980,2.830],
"number_observations": 71269,
"number_observations_unique": 11128,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 9.6
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [3.160,2.980],
"number_observations": 67923,
"number_observations_unique": 10592,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 13.1
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [3.380,3.160],
"number_observations": 63916,
"number_observations_unique": 9953,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 17.1
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [3.650,3.380],
"number_observations": 59609,
"number_observations_unique": 9266,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 23.6
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [4.000,3.650],
"number_observations": 54851,
"number_observations_unique": 8507,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 28.3
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [4.470,4.000],
"number_observations": 49236,
"number_observations_unique": 7647,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 36.3
},
{
"type": "Completeness",
"value": 99.900
}
]
},
{
"resolution_limits": [5.160,4.470],
"number_observations": 44194,
"number_observations_unique": 6828,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 40.9
},
{
"type": "Completeness",
"value": 99.900
}
]
},
{
"resolution_limits": [6.320,5.160],
"number_observations": 36913,
"number_observations_unique": 5678,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 35.2
},
{
"type": "Completeness",
"value": 99.700
}
]
},
{
"resolution_limits": [8.940,6.320],
"number_observations": 28473,
"number_observations_unique": 4391,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 39.9
},
{
"type": "Completeness",
"value": 99.400
}
]
},
{
"resolution_limits": [89.800,8.940],
"number_observations": 15153,
"number_observations_unique": 2377,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 60.0
},
{
"type": "Completeness",
"value": 98.300
}
]
}
]
}