Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4ba5fd77bb2ccc2bf1d8ec6e1f445a5b",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 117.01,
"b": 46.77,
"c": 77.71,
"alpha": 90.00,
"beta": 117.71,
"gamma": 90.00
},
"wavelengths": [0.97910],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [68.799,2.000],
"number_observations_unique": 24867,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "I/SigI",
"value": 14.1
},
{
"type": "Completeness",
"value": 97.5
}
]
},
"refln_shells": [
{
"resolution_limits": [2.050,2.000],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.365
},
{
"type": "I/SigI",
"value": 3.480
},
{
"type": "Completeness",
"value": 97.2
}
]
},
{
"resolution_limits": [2.110,2.050],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.286
},
{
"type": "I/SigI",
"value": 4.570
},
{
"type": "Completeness",
"value": 97.7
}
]
},
{
"resolution_limits": [2.170,2.110],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.284
},
{
"type": "I/SigI",
"value": 5.200
},
{
"type": "Completeness",
"value": 98.0
}
]
},
{
"resolution_limits": [2.240,2.170],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.268
},
{
"type": "I/SigI",
"value": 5.940
},
{
"type": "Completeness",
"value": 98.0
}
]
},
{
"resolution_limits": [2.310,2.240],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.244
},
{
"type": "I/SigI",
"value": 7.050
},
{
"type": "Completeness",
"value": 96.4
}
]
},
{
"resolution_limits": [2.390,2.310],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.234
},
{
"type": "I/SigI",
"value": 7.390
},
{
"type": "Completeness",
"value": 94.3
}
]
},
{
"resolution_limits": [2.480,2.390],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.212
},
{
"type": "I/SigI",
"value": 8.770
},
{
"type": "Completeness",
"value": 99.0
}
]
},
{
"resolution_limits": [2.580,2.480],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.169
},
{
"type": "I/SigI",
"value": 10.660
},
{
"type": "Completeness",
"value": 99.3
}
]
},
{
"resolution_limits": [2.700,2.580],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.136
},
{
"type": "I/SigI",
"value": 12.340
},
{
"type": "Completeness",
"value": 99.2
}
]
},
{
"resolution_limits": [2.830,2.700],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.105
},
{
"type": "I/SigI",
"value": 14.710
},
{
"type": "Completeness",
"value": 99.2
}
]
},
{
"resolution_limits": [2.980,2.830],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.080
},
{
"type": "I/SigI",
"value": 17.430
},
{
"type": "Completeness",
"value": 98.0
}
]
},
{
"resolution_limits": [3.160,2.980],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "I/SigI",
"value": 19.810
},
{
"type": "Completeness",
"value": 97.6
}
]
},
{
"resolution_limits": [3.380,3.160],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.051
},
{
"type": "I/SigI",
"value": 22.270
},
{
"type": "Completeness",
"value": 95.1
}
]
},
{
"resolution_limits": [3.650,3.380],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.040
},
{
"type": "I/SigI",
"value": 25.420
},
{
"type": "Completeness",
"value": 94.4
}
]
},
{
"resolution_limits": [4.000,3.650],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 28.190
},
{
"type": "Completeness",
"value": 98.6
}
]
},
{
"resolution_limits": [4.470,4.000],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 30.740
},
{
"type": "Completeness",
"value": 98.9
}
]
},
{
"resolution_limits": [5.160,4.470],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 32.870
},
{
"type": "Completeness",
"value": 98.5
}
]
},
{
"resolution_limits": [6.320,5.160],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 29.530
},
{
"type": "Completeness",
"value": 95.5
}
]
},
{
"resolution_limits": [8.940,6.320],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 31.760
},
{
"type": "Completeness",
"value": 95.3
}
]
},
{
"resolution_limits": [68.799,8.940],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 33.710
},
{
"type": "Completeness",
"value": 98.4
}
]
}
]
}